Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T09960 | Target Info | |||
| Target Name | C-C chemokine receptor type 5 (CCR5) | ||||
| Synonyms |
HIV-1 fusion coreceptor; HIV-1 fusion co-receptor; Chemokine receptor CCR5; CMKBR5; CHEMR13; CD195 antigen; CD195; CCR-5; CC-CKR-5; C-C CKR-5
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| Target Type | Successful Target | ||||
| Gene Name | CCR5 | ||||
| Biochemical Class | GPCR rhodopsin | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 71 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-dihydroxyphenyl)-4-pentenyl)phenyl)-2-thienylacetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4077902; J3.547.216I; N-[4-[(E)-5-(3,4-dihydroxyphenyl)-3-oxo-pent-4-enyl]phenyl]-2-(2-thienyl)acetamide
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
Methyl 4-[[4-[4-propan-2-yloxy-3-(pyrazine-2-carbonylamino)phenyl]piperazin-1-yl]methyl]benzenesulfonate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3263032; BDBM50013318
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-dihydroxyphenyl)-4-pentenyl)phenyl)cyclohexanecarboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4071775; J3.547.208H; N-[4-[(E)-5-(3,4-dihydroxyphenyl)-3-oxo-pent-4-enyl]phenyl]cyclohexanecarboxamide
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-diacetoxyphenyl)-4-pentenyl)phenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4097138; J3.547.205C; [2-acetoxy-4-[(E)-5-(4-benzamidophenyl)-3-oxo-pent-1-enyl]phenyl] acetate
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-diacetoxyphenyl)-4-pentenyl)phenyl)-2-thienylacetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4099567; J3.547.217G; [2-acetoxy-4-[(E)-3-oxo-5-[4-[[2-(2-thienyl)acetyl]amino]phenyl]pent-1-enyl]phenyl] acetate
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-[5-[4-[(4-Cyanophenyl)methyl]piperazin-1-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3263027; BDBM50013312
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-dihydroxyphenyl)-4-pentenyl)phenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4092559; J3.547.211H; N-[4-[(E)-5-(3,4-dihydroxyphenyl)-3-oxo-pent-4-enyl]phenyl]benzamide
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-[5-[4-[(3-Nitrophenyl)methyl]piperazin-1-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3263024; BDBM50013307
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-methyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813444; SCHEMBL6190272
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| Activity |
IC50 = 50000 nM
|
[3] | |||
| Compound Name |
N-[5-[4-[(3,5-Dinitrophenyl)methyl]piperazin-1-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3259852; BDBM50013310
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
N-[4-[(E)-5-(3,4-Dihydroxyphenyl)-3-oxo-pent-4-enyl]phenyl]-4-nitro-benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4083381
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-(4-((E)-3-Oxo-5-(3,4-dihydroxyphenyl)-4-pentenyl)phenyl)-p-methylbenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4063289; J3.547.210J; N-[4-[(E)-5-(3,4-dihydroxyphenyl)-3-oxo-pent-4-enyl]phenyl]-4-methyl-benzamide
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| Activity |
EC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
N-[5-[4-[(4-Fluorophenyl)methyl]piperazin-1-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3263028; BDBM50013313
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
1,10-Phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
o-phenanthroline; Phenanthroline; orthophenanthroline; 4,5-diazaphenanthrene; 1,10-o-phenanthroline; 2-phenanthroline; 1,10-Phenanthroline anhydrous; [1,10]phenanthroline; beta-phenanthroline; 1,10-Fenanthrolin; .beta.-Phenanthroline; 1,10-Phenanthroline, Anhydrous; MFCD00011678; UNII-W4X6ZO7939; MLS000069797; CHEMBL415879; NSC 4265; W4X6ZO7939; NSC203545; NSC4265; SMR000058190; DSSTox_CID_5857; pyridino[3,2-h]quinoline; DSSTox_RID_77950; DSSTox_GSID_25857; 1,10-Phenanthroline, 99+%; MLS002701886; 1,10-Fenanthrolin [Czech]; Activ-8; NSC-4265; CCRIS 4855; EINECS 200-629-2; NSC 203545; phenantroline; o-Phenanthrolin; Cyto5A5; 1,10-phenanthrolin; 1,10-phenantroline; 1,10-phenathroline; 1,10 phenanthroline; 1,10-Fenanthroline; 1.10-phenanthroline; 1,1 0-phenanthroline; ACMC-209nwd; Opera_ID_711; [1,10]-Phenanthroline; Lopac-P-9375; Activ-8 in hexylene glycol; cid_1318; SCHEMBL8312; NCIStruc1_000192; NCIStruc2_000199; Lopac0_000985; KSC241K8T; ARONIS014409; DTXSID1025857; WLN: T B666 CN NNJ; 1,10 CPhenanthroline anhydrous; NCI4265; 1,10-Phenanthroline (anhydrous); 1,10-Phenanthroline, >=99%; 1,10-Phenanthroline,hydrochloride; HMS2234D03; HMS3263E11; HMS3371F11; ZINC164363; KS-000044UM; Tox21_201998; Tox21_303111; Tox21_500985; ANW-35243; BDBM50092158; CCG-38059; NCGC00013043; s6830; SBB089685; STL069281; AKOS000281773; CS-W004544; DB02365; HY-W004544; LP00985; MCULE-2911225521; NSC-203545; SDCCGSBI-0050958.P003; NCGC00013043-02; NCGC00013043-03; NCGC00013043-04; NCGC00013043-05; NCGC00013043-06; NCGC00013043-07; NCGC00013043-08; NCGC00013043-09; NCGC00013043-10; NCGC00013043-13; NCGC00091201-01; NCGC00091201-02; NCGC00091201-03; NCGC00091201-04; NCGC00257123-01; NCGC00259547-01; NCGC00261670-01; AC-18353; AK-27000; AS-14043; BR-27000; NCI60_003976; SC-23392; DB-013750; EU-0100985; FT-0606035; FT-0660636; P0221; P0879; P1826; ST45051101; Solution forms containing 1,10-phenanthroline; C-1044; C00604; M-5271; P 9375; 011P678; A835532; AA-860/25004133; Q416005; SR-01000076093; CU-00000000156-1; J-610043; SR-01000076093-1; W-104740; F3377-1129
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| Activity |
IC50 = 50118.72 nM
|
[4] | |||
| Compound Name |
4-[4-[[(3S)-1-Butyl-3-[(S)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1668022; SCHEMBL5346716
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| Activity |
IC50 = 51000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-ethoxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436822; BDBM50441878
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| Activity |
IC50 = 51800 nM
|
[5] | |||
| Compound Name |
(3R)-1-Butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-9-[(4-phenoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undecane-2,5-dione;hydrochloride
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL536754; SCHEMBL5356840
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| Activity |
IC50 = 53000 nM
|
[3] | |||
| Compound Name |
N-[4-[5-(3,4-Dihydroxyphenyl)-3-oxo-pentyl]phenyl]-2-(2-thienyl)acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4072528
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| Activity |
EC50 = 55370 nM
|
[1] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-methoxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436814; BDBM50441884
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| Activity |
IC50 = 56000 nM
|
[5] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-methyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813445; SCHEMBL6186852
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| Activity |
IC50 = 59000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[(4-Acetamidophenyl)methyl]piperidin-4-yl]-2-methoxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436817; BDBM50441869
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| Activity |
IC50 = 59000 nM
|
[5] | |||
| Compound Name |
[(1R,2S,3S,5R,6R,8S,10E,12R,13S,15R,16S,17R,18S)-18-Benzyl-6-hydroxy-6,8,15,16-tetramethyl-7,20-dioxo-4,14-dioxa-19-azapentacyclo[10.8.0.01,17.03,5.013,15]icos-10-en-2-yl] acetate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL449278; 19,20-Epoxycytochalasin Q; BDBM50242055
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| Activity |
IC50 = 60000 nM
|
[6] | |||
| Compound Name |
N-[2-Ethoxy-5-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]phenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436823; BDBM50441872
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| Activity |
IC50 = 61000 nM
|
[5] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436715; BDBM50441864
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| Activity |
IC50 = 61000 nM
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[5] | |||
| Compound Name |
N-[5-[1-[(4-Aminophenyl)methyl]piperidin-4-yl]-2-ethoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436820; BDBM50441876
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| Activity |
IC50 = 63000 nM
|
[2] | |||
| Compound Name |
Neocuproine
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Investigative | Compound Info | ||
| Synonyms |
2,9-Dimethyl-1,10-phenanthroline; 1,10-Phenanthroline, 2,9-dimethyl-; Neocuproin; 2,9-Dimethylphenanthroline; 2,9-Dimethyl-o-phenanthroline; neo-Cuproin; DMPHEN; Neocuproine hemihydrate; NSC4280; UNII-8E7D2SH3BV; 8E7D2SH3BV; MLS001194484; GNF-PF-5611; MFCD00004973; SMR000555011; DMPHEN; NSC 4280; Neocuproin; VUF 7738; 2,9-dimethylpyridino[3,2-h]quinoline; MFCD00149306; NSC 4280; EINECS 207-601-9; 2,9-Dimethyl-1,10-phenanthroline hemihydrate, 98%; 2,10-phenanthroline; Neocuproine, >=98%; 1, 2,9-dimethyl-; NCIMech_000034; Oprea1_068014; cid_65237; KSC496I5N; 484-11-7 (anhydrous); SCHEMBL124563; CHEMBL375781; DTXSID5060065; BDBM64740; CTK3J6456; HMS2230M06; HMS3373K19; KUC107774N; ZINC119332; 2,10-dimethyl-1,9-phenanthroline; BCP18357; DNDI1343110; KS-00000VG9; KSC-09-264B; NSC-4280; 2,9-di-methyl-1,10-phenanthroline; 3,6-Dimethyl-4,5-diazaphenanthrene; ANW-41947; CCG-16034; CCG-35468; SBB008718; AKOS000511700; CS-W004563; MCULE-3651567163; NCGC00245843-01; AK134888; AS-14894; NCI60_003986; SC-18587; ST013881; SY010909; DB-050426; D0771; EU-0036872; FT-0610770; Neocuproine, Vetec(TM) reagent grade, 98%; A-8054; 2,9-Dimethyl-1,10-phenanthroline Neocuproine; AB00443806-10; AB00443806-12; A827529; Q409347; J-610070; BRD-K16598630-001-05-7; Z2301294930; 2,9-DIMETHYL-1,10-PHENANTHROLINE, REAGENT (ACS)
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| Activity |
EC50 = 63095.73 nM
|
[4] | |||
| Compound Name |
4-Methyl-1,10-phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
1,10-Phenanthroline, 4-methyl-; MFCD00004978; CHEMBL316589; 4-methylpyridino[3,2-h]quinoline; ACMC-1AIHJ; cid_93149; MLS001359987; SCHEMBL912010; DTXSID2067612; 4-Methyl-[1,10]phenanthroline; CTK3J6175; HMS3025J12; ZINC120467; 3351AB; ANW-66139; BDBM50401346; SBB009139; AKOS015916743; 4-Methyl-1,10-phenanthroline, 97%; CS-W004551; MCULE-4398278647; NCGC00247290-01; AC-29166; AS-59410; SMR001224335; ST080587; FT-0692529; 4-Methyl-1,10-phenanthroline1,10-phenanthroline, 4-Methyl-
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| Activity |
IC50 = 63095.73 nM
|
[4] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-ethoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436818; BDBM50441870
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| Activity |
IC50 = 64000 nM
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[5] | |||
| Compound Name |
N-[5-[1-[(4-Nitrophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436716; BDBM50441863
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| Activity |
IC50 = 65700 nM
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[5] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(R)-cyclobutyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813438; SCHEMBL6189072
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| Activity |
IC50 = 66000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[(4-Aminophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436713; BDBM50441866
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| Activity |
IC50 = 66200 nM
|
[5] | |||
| Compound Name |
N-[[5,7-Dimethyl-8-[[(4-nitrobenzoyl)amino]methyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]-4-nitrobenzamide;chloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604304; BDBM50109888
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| Activity |
IC50 = 67700 nM
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[7] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-2,5-dioxo-1-pentyl-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813450; SCHEMBL6186337
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| Activity |
IC50 = 68000 nM
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[3] | |||
| Compound Name |
(3R)-1-Butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-9-[[4-(4-hydroxyphenoxy)phenyl]methyl]-1,4,9-triazaspiro[5.5]undecane-2,5-dione;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813270; SCHEMBL5350051
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| Activity |
IC50 = 68000 nM
|
[3] | |||
| Compound Name |
4-Methoxy-N-[[8-[[(4-methoxybenzoyl)amino]methyl]-5,7-dimethyl-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]benzamide;chloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604309
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| Activity |
IC50 = 69000 nM
|
[7] | |||
| Compound Name |
5-[[4-(4-Benzyl-1H-pyrazol-5-yl)-1-piperidyl]methyl]-2-methoxy-pyrimidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3608771; BDBM50112267; ZINC67851147; MCULE-8614013584
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| Activity |
IC50 = 70000 nM
|
[8] | |||
| Compound Name |
N-[5-[1-[(4-Acetamidophenyl)methyl]piperidin-4-yl]-2-methoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436722; BDBM50441882
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| Activity |
IC50 = 70800 nM
|
[5] | |||
| Compound Name |
N-[2-Methoxy-5-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]phenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436815; BDBM50441883
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| Activity |
IC50 = 73000 nM
|
[5] | |||
| Compound Name |
N-[5-[1-[(4-Aminophenyl)methyl]piperidin-4-yl]-2-methoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436721; BDBM50441881
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|
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| Activity |
IC50 = 77000 nM
|
[5] | |||
| Compound Name |
N-[5-[1-[(4-Aminophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436717; BDBM50441862
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| Activity |
IC50 = 77800 nM
|
[5] | |||
| Compound Name |
1-Cyclohexyl-4-[(2-fluorophenyl)-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]methyl]piperazine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL375591; BDBM50205737; AKOS000782486; MCULE-8543027384; 1-((1-(4-fluorobenzyl)-1H-tetrazol-5-yl)(2-fluorophenyl)methyl)-4-cyclohexylpiperazine; Piperazine, 1-cyclohexyl-4-[(2-fluorophenyl)[1-[(4-fluorophenyl)methyl]-1H-tetrazol-5-yl]methyl]-
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| Activity |
IC50 = 79400 nM
|
[9] | |||
| Compound Name |
2,2'-Bipyridine
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Investigative | Compound Info | ||
| Synonyms |
2,2'-Dipyridyl; 2,2'-Bipyridyl; Bipyridine; 2,2'-Dipyridine; 2-(2-Pyridyl)pyridine; 2,2'-Bipyridin; alpha,alpha'-Dipyridyl; alpha,alpha'-Bipyridyl; Bipyridyl; alpha,alpha'-Dipyridine; AA-DP; 2,2-bipyridyl; dipyridyl; 2-pyridin-2-ylpyridine; 2-(pyridin-2-yl)pyridine; NSC 1550; MFCD00006212; .alpha.,.alpha.'-Bipyridine; [2,2]bipyridinyl; NSC 615009; UNII-551W113ZEP; alpha,alpha'-Bipyridine; Umdipyridyl; .alpha.,.alpha.'-Bipyridyl; .alpha.,.alpha.'-Dipyridyl; [2,2']BIPYRIDINYL; .alpha.,.alpha.'-Dipyridine; CHEMBL39879; MLS000069417; 551W113ZEP; CI 588; NSC615009; SMR000059069; 2,2'-Bipyridine, 99%; 2,2'-Dipyridyl, 99+%; 2,2-Bipyridine; 2,2 Bipyridyl; 2,2-Dipyridyl; 2,2' Bipyridine; CCRIS 3426; HSDB 5423; alpha,alpha'-Dwupirydylu [Polish]; alpha,alpha'-Dwupirydylu; EINECS 206-674-4; BRN 0113089; bi-pyridine; AI3-00491; 2-pyridylpyridine; 2,2bipyridyl; 2'2-bipyridine; 2,2'Bipyridine; 2, 2-Bipyridine; 2,2' bipyridyl; 2,2`-Bipyridine; [2,2']bipyridyl; 2,2''-bipyridyl; 2,2''-dipyridyl; 2,2''-bipyridine; 2,2''-dipyridine; 2,2'- bipyridine; 2,2\\'-bipyridine; 2,2''-Bipyridin; PubChem2134; alpha, alpha-Dipyridyl; 2-pyridin-2-ylpyridin; ACMC-209ino; alpha,alpha''-bipyridyl; alpha,alpha''-dipyridyl; alpha,alpha''-bipyridine; alpha,alpha''-dipyridine; Maybridge3_006205; Opera_ID_1615; Lopac-D-7505; 2,2'-Bipyridine, ACS; (aR)-2,2'-Bipyridine; (aS)-2,2'-Bipyridine; EC 206-674-4; SCHEMBL5922; UPCMLD00WV-71; DSSTox_CID_20635; DSSTox_RID_79518; DSSTox_GSID_40635; Lopac0_000471; 5-23-08-00016 (Beilstein Handbook Reference); KSC226A4T; 2,2'-Dipyridyl, ACS grade; WLN: T6NJ B- BT6NJ; DTXSID9040635; CTK1C6049; NSC1550; HMS1448K01; HMS2234F20; HMS3261O04; HMS3371D05; ZINC105227; ACT09618; BCP27263; NSC-1550; STR02551; Tox21_301430; Tox21_500471; ANW-28450; BDBM50042874; CCG-54708; RW2020; SBB079580; STL282738; AKOS004901459; 2,2'-Bipyridyl, p.a., 99.5%; AC-7556; AM81312; CS-W009134; FS-1056; LP00471; LS21121; MCULE-8524562351; NSC-615009; SC11754; SDCCGSBI-0050456.P002; IDI1_017592; NCGC00015364-01; NCGC00015364-02; NCGC00015364-03; NCGC00015364-04; NCGC00015364-05; NCGC00015364-07; NCGC00093368-02; NCGC00093368-03; NCGC00255575-01; NCGC00261156-01; 2,2'-Bipyridyl, >=98.0% (NT); AK-41113; BP-10293; BR-41113; SC-03874; 2,2'-Bipyridine;2-(pyridin-2-yl)pyridine; DB-013205; 2,2'-Bipyridyl, ReagentPlus(R), >=99%; B0468; EU-0100471; FT-0632048; FT-0636412; FT-0637152; ST50308286; 66D187; D 7505; D-7200; D-7250; D-7255; M-6336; 2,2'-Dipyridyl, JIS special grade, >=99.0%; 2,2'-Bipyridyl, Vetec(TM) reagent grade, 98%; Q209143; SR-01000075829; 2,2'-Bipyridyl, PESTANAL(R), analytical standard; SR-01000075829-1; SR-01000075829-3; Z57160161; F0001-1045
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||||
| Activity |
IC50 = 79432.82 nM
|
[4] | |||
| Compound Name |
Fuscinarin
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL469856; VXRIEWIAVSRHJN-UHFFFAOYSA-; BDBM50242056
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||||
| Activity |
IC50 = 80000 nM
|
[10] | |||
| Compound Name |
4-Fluoro-N-[[8-[[(4-fluorobenzoyl)amino]methyl]-5,7-dimethyl-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]benzamide;chloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604305; BDBM50109889
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||||
| Activity |
IC50 = 80900 nM
|
[7] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(R)-cyclopropyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813437; SCHEMBL6189622
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||||
| Activity |
IC50 = 81000 nM
|
[3] | |||
| Compound Name |
Benzyl ethyl{1-[3-phenyl-5-(phenylsulfonyl)heptyl]piperidin-4-yl}carbamate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL120513; CTK6E7048; BDBM50148689; [1-(5-Benzenesulfonyl-3-phenyl-heptyl)-piperidin-4-yl]-ethyl-carbamic acid benzyl ester; [1-(5-Benzenesulfonyl-3-phenyl-heptyl)-piperidin-4-yl]-ethyl-carbamic acid, benzyl ester; benzyl N-[1-[5-(benzenesulfonyl)-3-phenyl-heptyl]-4-piperidyl]-N-ethyl-carbamate
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||||
| Activity |
IC50 = 88000 nM
|
[11] | |||
| Compound Name |
N-[5-[1-[(4-Acetamidophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436718; BDBM50441861
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||||
| Activity |
IC50 = 88100 nM
|
[5] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-methoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436719; BDBM50441880
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||||
| Activity |
IC50 = 90000 nM
|
[5] | |||
| Compound Name |
(3R)-1-Butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-9-[[4-(4-methoxyphenoxy)phenyl]methyl]-1,4,9-triazaspiro[5.5]undecane-2,5-dione;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813269; SCHEMBL5348778
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||||
| Activity |
IC50 = 91000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[(4-Acetamidophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436714; BDBM50441865
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||||
| Activity |
IC50 = 92200 nM
|
[5] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-(2-methoxyethyl)-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813454; SCHEMBL5350455
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||||
| Activity |
IC50 = 98000 nM
|
[3] | |||
| Compound Name |
3,5-Bis[(Z)-dec-1-enyl]-2,4,6-trimethylpyridine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057808; BDBM50387952
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||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3,5-Bis[(Z)-dec-1-enyl]-2-(3-methoxypropyl)-4,6-dimethylpyridine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2057809; BDBM50387953
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||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
4-Cyano-N-[[8-[[(4-cyanobenzoyl)amino]methyl]-5,7-dimethyl-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]benzamide;chloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604306; BDBM50109890
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||||
| Activity |
IC50 = 101200 nM
|
[7] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-hexyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813451; SCHEMBL6190791
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||||
| Activity |
IC50 = 110000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-2,5-dioxo-1-propyl-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813448; SCHEMBL5346488
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||||
| Activity |
IC50 = 112000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[(4-Acetamidophenyl)methyl]piperidin-4-yl]-2-ethoxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436821; BDBM50441877
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||||
| Activity |
IC50 = 115000 nM
|
[5] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(R)-hydroxy(oxan-4-yl)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813441; SCHEMBL5612202
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| Activity |
IC50 = 120000 nM
|
[3] | |||
| Compound Name |
N-[[5,7-Dimethyl-8-[[[4-(trifluoromethyl)benzoyl]amino]methyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]-4-(trifluoromethyl)benzamide;chloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604303; BDBM50109887
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| Activity |
IC50 = 121500 nM
|
[7] | |||
| Compound Name |
1,10-Phenanthroline-2,9-dicarbaldehyde
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Investigative | Compound Info | ||
| Synonyms |
1,10-Phenanthroline-2,9-dicarboxaldehyde; 2,9-diformyl-1,10-phenanthroline; [1,10]Phenanthroline-2,9-dicarbaldehyde; CHEMBL2205803; Cambridge id 5478062; SCHEMBL1088335; ZINC218307; ALBB-027841; BDBM50401341; MFCD00774291; SBB098585; AKOS001703860; MCULE-6152111599; BS-17263; CS-0030363; pyridino[3,2-h]quinoline-2,9-dicarbaldehyde; AB00086514-01; J-400084; Q30948420
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| Activity |
IC50 = 125892.54 nM
|
[4] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(S)-hydroxy-(4-hydroxycyclohexyl)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813443
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||||
| Activity |
IC50 = 129000 nM
|
[3] | |||
| Compound Name |
N-[5-[1-[[4-(Diethylamino)phenyl]methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2436711; BDBM50441868
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||||
| Activity |
IC50 = 138000 nM
|
[5] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(R)-hydroxy-(4-hydroxycyclohexyl)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813442; SCHEMBL6186719; SCHEMBL6186728; SCHEMBL6189104
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||||
| Activity |
IC50 = 140000 nM
|
[3] | |||
| Compound Name |
10-Methoxydihydrofuscin
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL459020; 5,6-dihydroxy-1-methoxy-4,8,8-trimethyl-1,4,9,10-tetrahydropyrano[4,3-f]chromen-2-one; BDBM50242233
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| Activity |
IC50 = 154000 nM
|
[10] | |||
| Compound Name |
4-Amino-N-[[8-[[(4-aminobenzoyl)amino]methyl]-5,7-dimethyl-2,3-dihydro-1H-indolizin-4-ium-6-yl]methyl]benzamide;chloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3604307; BDBM50109891
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||||
| Activity |
IC50 = 173900 nM
|
[7] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-ethyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813447; SCHEMBL6185327
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| Activity |
IC50 = 178000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-(3-hydroxybutyl)-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813453; SCHEMBL6189193
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| Activity |
IC50 = 180000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(S)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1668020; SCHEMBL6190417
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| Activity |
IC50 = 182000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-heptyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813452; SCHEMBL6188118
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| Activity |
IC50 = 190000 nM
|
[3] | |||
| Compound Name |
Abametapir
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Investigative | Compound Info | ||
| Synonyms |
5,5'-Dimethyl-2,2'-bipyridine; 5,5'-Dimethyl-2,2'-dipyridyl; 5,5'-Dimethyl-2,2'-bipyridyl; 6,6'-Bi-3-picoline; 2,2'-BIPYRIDINE, 5,5'-DIMETHYL-; HA-44; 6,6'-Di-3-picolyl; 6,6'-Di-3-picoline; UNII-6UO390AMFB; 5-methyl-2-(5-methylpyridin-2-yl)pyridine; MFCD01740554; 6UO390AMFB; CHEMBL2205807; 5,5'-dimethyl-2,2'-bipyridinyl; 5,5 -Dimethyl-2,2 -bipyridine; Xeglyze; BRN 0123183; Abametapir [USAN:INN]; Xeglyze(Abametapir); Xeglyze (TN); PubChem24353; Abametapir (USAN/INN); ACMC-209eb4; SCHEMBL351152; 2,2 -Bis-(5-methylpyridyl); DTXSID00170095; ZINC403335; 9238AA; ANW-22814; BDBM50401351; LT0042; s5752; 5,5''-Dimethyl-2,2''-bipyridine; AKOS005257775; CS-W004546; DB11932; MCULE-8581798506; SB17220; 5,5'-Dimethyl-2,2'-dipyridyl, 98%; AK-63331; DS-15219; SY052805; FT-0689891; D10687; W-108621; Q27265547
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| Activity |
IC50 = 199526.23 nM
|
[4] | |||
| Compound Name |
2,9-Bis(bromomethyl)-1,10-phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
NSC602850; CHEMBL1976682; SCHEMBL1258482; CTK2G4820; DTXSID70326587; ZINC1608162; BDBM50401340; NSC-602850; NCI60_004569; 1,10-Phenanthroline, 2,9-bis(bromomethyl)-
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| Activity |
IC50 = 199526.23 nM
|
[4] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 20 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
N-[4-[5-(3,4-Dihydroxyphenyl)-3-oxo-pentyl]phenyl]-4-methoxy-benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4091704
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| Activity |
EC50 > 200000 nM
|
[1] | |||
| Compound Name |
4-[4-[[(3R)-1-Butyl-3-[(1R)-1-hydroxy-2-methylpropyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813436; SCHEMBL5343305
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| Activity |
IC50 = 229000 nM
|
[3] | |||
| Compound Name |
N-(1-Benzylpiperidin-4-yl)-2-(5-methyl-4-p-tolyl-4H-1,2,4-triazol-3-ylthio)acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL219769; ZINC9717089; BDBM50205733; AKOS034429265; MCULE-3523916063; Z52110119; N-(1-benzyl-4-piperidyl)-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide; N-(1-benzylpiperidin-4-yl)-2-{[5-methyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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| Activity |
IC50 = 269200 nM
|
[9] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-2,5-dioxo-1-(2,2,3,3,3-pentafluoropropyl)-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813458; SCHEMBL6188884
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| Activity |
IC50 = 270000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-ethyl-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813446; SCHEMBL6190423
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| Activity |
IC50 = 295000 nM
|
[3] | |||
| Compound Name |
4,7-Dimethyl-1,10-phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
4,7-Dimethyl-o-phenanthroline; 4,7-DIMETHYL-[1,10]PHENANTHROLINE; 1,10-Phenanthroline, 4,7-dimethyl-; MFCD00004979; UNII-P3YJ54Z8ZO; P3YJ54Z8ZO; CHEMBL593442; 4,7-dimethylpyridino[3,2-h]quinoline; ACMC-1CJN6; Oprea1_825186; SCHEMBL182930; DTXSID9062932; CTK3J6706; KS-00000NVT; NSC4281; ZINC120461; ALBB-023379; NSC 4281; NSC-4281; EINECS 221-827-5; ANW-13810; BDBM50401348; SBB008716; AKOS003369115; CS-W004562; DB02586; DS-2431; NCGC00247283-01; AK-84388; ST078007; SY037737; DB-050425; D0772; FT-0634746; R2743; 1,10-phenanthroline, 4,7-dimethyl-, hydrate; 248D053; Q27093559; 5-Fluoro-l-(2-furanidinyl)-4-(trimethylsilyloxy)-2-pyrimidone
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| Activity |
IC50 = 300000 nM
|
[4] | |||
| Compound Name |
4,4'-Dimethyl-2,2'-bipyridine
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Investigative | Compound Info | ||
| Synonyms |
4,4'-Dimethyl-2,2'-bipyridyl; 4,4'-Dimethyl-2,2'-dipyridyl; 2,2'-Bi-4-picoline; 2,2'-BIPYRIDINE, 4,4'-DIMETHYL-; 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2,2'-Bi(gamma-picoline); 2,2'-Bipyridyl, 4,4'-dimethyl-; MFCD00006441; 2,2'-Di-4-picolyl; NSC3261; CHEMBL101165; 4,4'-Dimethyl-2,2'-bipyridyl, 99+%; 4-methyl-2-(4-methyl(2-pyridyl))pyridine; NSC 3261; EINECS 214-483-2; 4,2'-bipyridine; 4,2'-dipyridyl; PubChem9622; 2, 4,4'-dimethyl-; ACMC-2099jr; 2,2'-Bi(gam.; KSC909E7H; SCHEMBL181893; 4,4'dimethyl 2,2'bipyridine; 4,4-Dimethyl-2,2-Bipyridyl; DTXSID3061552; CTK8A9273; KS-00000DTC; 2,2'-Bi-4-picoline (8CI); 4,4`-Dimethyl-2,2`-dipyridyl; 4,4' dimethyl 2,2' bipyridine; 4,4'-dimethyl 2,2'-bipyridine; ZINC120136; ACN-S002665; ACN-S003306; ACT08966; NSC-3261; 4,4'-Dimethyl-[2,2']bipyridinyl; 4,4\\'-Dimethyl-2,2\\'-bipyridyl; ANW-16645; BBL104382; BDBM50401350; RW1527; RW1982; SBB008769; STL558645; AKOS000344143; AC-5118; AM84345; CS-W002003; LS21016; MCULE-2447382595; SC11757; 4,4'-Dimethyl-2,2'-dipyridyl, 99%; AK-84390; AS-17512; SC-00426; SY011392; B0852; FT-0609153; ST50407480; V0506; B-6468; 134D356; 4,4'-Dimethyl-2,2'-dipyridyl, 99.5%, purified by sublimation; 4,4'-Dimethyl-2,2'-dipyridyl, for spectrophotometric det., >=99.0%
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| Activity |
IC50 = 316227.77 nM
|
[4] | |||
| Compound Name |
4-[4-[[(3S)-1-Butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzoic acid;hydrochloride
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1668021; SCHEMBL6186135
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||||
| Activity |
IC50 = 380000 nM
|
[3] | |||
| Compound Name |
6,6'-Dimethyl-2,2'-bipyridine
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Investigative | Compound Info | ||
| Synonyms |
6,6'-Dimethyl-2,2'-bipyridyl; 6,6'-Bi-2-picoline; 2,2'-BIPYRIDINE, 6,6'-DIMETHYL-; 6,6'-Dimethyl-2,2'-dipyridyl; 2-methyl-6-(6-methylpyridin-2-yl)pyridine; UNII-AF3HZ0ZAN4; AF3HZ0ZAN4; CHEMBL2205806; 6,6'-dimethyl-2,2'-dipyridine; MFCD00059776; 6,6-Di-2-Picolyl; 6-methyl-2-(6-methyl(2-pyridyl))pyridine; NSC 4705; EINECS 224-566-5; BRN 0128972; NSC4705; Bipicoline; 98%; ACMC-209jwi; 6,6'-Di-2-picolyl; SCHEMBL196966; CTK8B1701; KS-00000FCF; DTXSID30196041; 6,6'-Dimethyl-2,2'-bibyridine; ZINC403297; BCP30986; EBD38551; NSC-4705; 6,6'-dimethyl-2,2'-bipyridinine;; ANW-30064; BDBM50401355; SBB038122; AKOS000268334; AC-7735; CS-W004545; MCULE-5271745802; QC-1387; 6,6'-Dimethyl-2,2'-dipyridyl, 98%; AK-89714; AS-20071; SC-08562; SY052412; AB0053939; DB-050571; 2-methyl-6-(6-methyl-2-pyridinyl)pyridine; AM20051181; B0842; FT-0692834; ST50115136; Z4763; Q-9313; 100B222; A826492; W-200553; 6,6'-Bi-2-picoline;6,6'-Dimethyl-2,2'-bipyridyl
Click to Show/Hide
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||||
| Activity |
IC50 = 501187.23 nM
|
[4] | |||
| Compound Name |
2,6-Bis(2-pyridyl)-4(1H)-pyridone
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Investigative | Compound Info | ||
| Synonyms |
[2,2':6',2''-Terpyridin]-4'-ol; [2,2':6',2''-Terpyridin]-4'(1'H)-one; 2,6-dipyridin-2-yl-1H-pyridin-4-one; 2,2':6',2''-Terpyridin-4'-ol; CHEMBL2205804; MFCD01321386; [2,2,6,2-terpyridin]-4(1H)-one; 4'-HYDROXY-2,2':6',2''-TERPYRIDINE; 4-Terpyridone; ACMC-209bep; 1'H-[2,2',6',2'']Terpyridin-4'-one; ACMC-20m41v; SCHEMBL1988750; CTK0H0167; CTK0H4325; KS-00000USR; ZINC403259; KS-00001KN4; 2,6-bis-pyridyl-4-(1H)-pyridone; ANW-19055; BDBM50401356; MFCD06796976; 2,6-bis(2-pyridyl)-4(1H)pyridone; 2,6-Bis(pyridin-2-yl)pyridin-4-ol; AKOS015912996; AKOS015914629; 2,6-Di(2-pyridyl)-4(1H)-pyridone; 2,6-bis(pyridin-2-yl)-4(1h)-pyridone; AC-27853; AS-62574; SC-70393; SY052797; 2,6-di(pyridin-2-yl)pyridin-4(1h)-one; Z2460; 1'H-[2,2';6',2'']terpyridin-4'-on; 1'H-[2,2';6',2'']terpyridin-4'-one; 1'H-[2,2';6',2'']terpyridine-4'-one; 2,6-?Bis(2-?pyridyl)?-?4(1H)-pyridone; 2,6-Bis(pyridine-2-yl)pyridine-4(1H)-one; 6-(pyridin-2-yl)-[2,2'-bipyridine]-4-ol; 1'H-[2,2';6',2 '']terpyridine-4'-one; 2,6-Bis(2-pyridyl)-4(1H)-pyridone, 98%; J-005568; J-400598; 6-(pyridin-2-yl)-1,4-dihydro-[2,2'-bipyridin]-4-one
Click to Show/Hide
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||||
| Activity |
IC50 = 501187.23 nM
|
[4] | |||
| Compound Name |
1,10-Phenanthroline-2,9-diyldimethanol
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
(1,10-Phenanthroline-2,9-diyl)dimethanol; [9-(hydroxymethyl)-1,10-phenanthrolin-2-yl]methanol; NSC353096; UNII-1BR6ZZ33GT; 1BR6ZZ33GT; 2,9-Bis(hydroxymethyl)-1,10-phenanthroline; CHEMBL2205802; NSC 353096; SCHEMBL5301328; CTK5E6149; DTXSID90229329; ZINC391500; BDBM50401342; 1,10-Phenanthroline-2,9-dimethanol; NSC-353096; 2.9-Bis(hydroxymethyl)-1,10-phenanthroline; (9-Hydroxymethyl-[1,10]phenanthrolin-2-yl)-methanol
Click to Show/Hide
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||||
| Activity |
IC50 = 587000 nM
|
[4] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-1-[2-(dimethylamino)ethyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;dihydrochloride
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL6189707; CHEMBL3215636
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||||
| Activity |
IC50 = 640000 nM
|
[3] | |||
| Compound Name |
4-[4-[[(3R)-1-(2-Aminoethyl)-3-[(R)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;dihydrochloride
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
SCHEMBL6187923; CHEMBL3216516
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||||
| Activity |
IC50 = 750000 nM
|
[3] | |||
| Compound Name |
5-Methyl-1,10-phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
1,10-Phenanthroline, 5-methyl-; 5-Methylphenanthroline; CHEMBL98682; 1,10-Phenanthroline,5-methyl-; 5-Methyl-1,10-phenanthroline Hydrate [for Colorimetric Determination of Iron]; NSC 4272; EINECS 221-099-9; MFCD00004982; ACMC-1AGCX; SCHEMBL371564; DTXSID4062771; 5-Methyl-[1,10]phenanthroline; CTK4G4216; UJAQYOZROIFQHO-UHFFFAOYSA-; NSC4272; 5-methylpyridino[3,2-h]quinoline; ZINC120047; KS-000015CR; NSC-4272; BDBM50401345; AKOS015899630; CS-W004552; MCULE-2835878219; 5-Methyl-1,10-phenanthroline, >=99%; AC-29167; AS-59411; DB-050453; FT-0620583; M0300; ST50308418; 2-BROMO-5-(2,5-DIMETHYL)PYRROLIDYLPYRIDINE; J-200078; iron(+2) cation; 5-methyl-1,10-phenanthroline; sulfate; 5-Methyl-1,10-phenanthrolineHydrate[forColorimetricDeterminationofIron]
Click to Show/Hide
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||||
| Activity |
EC50 > 1000000 nM
|
[4] | |||
| Compound Name |
1,10-Phenanthroline-4,7-diol
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
4,7-Dihydroxy-1,10-phenanthroline; 1,10-Phenanthroline-4,7(1H,10H)-dione; MFCD00004975; CHEMBL1623498; 1,10-dihydro-1,10-phenanthroline-4,7-dione; 1,4,7,10-tetrahydro-1,10-phenanthroline-4,7-dione; pyridino[3,2-h]quinoline-4,7-diol; EINECS 223-493-6; ACMC-1COEH; Oprea1_631021; BIDD:GT0532; 1,1-Phenanthroline-4,7-diol; SCHEMBL1073354; DTXSID0063234; SCHEMBL19318056; CTK1C2783; KS-00000NVS; [1,10]phenanthroline-4,7-diol; 4,7-Dioxylato-1,10-phenanthroline; 5123AB; ANW-29036; BDBM50401357; SBB008750; STK700952; ZINC12341711; AKOS000520806; AKOS015918059; CS-W004566; DS-3423; MCULE-7566362799; NCGC00246264-01; AK106224; SC-08302; DB-050452; ST4066281; D3869; FT-0707691; 4,7-Dihydroxy-1,10-phenanthroline, Dye content >=30 %; 1,10-phenanthroline-4,7-diol4,7-dihydroxy-1,10-phenanthroline
Click to Show/Hide
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||||
| Activity |
IC50 > 1000000 nM
|
[4] | |||
| Compound Name |
5-Chloro-1,10-phenanthroline
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Investigative | Compound Info | ||
| Synonyms |
1,10-Phenanthroline, 5-chloro-; CHEMBL317115; MFCD00004980; 5-chloropyridino[3,2-h]quinoline; EINECS 224-098-1; ACMC-209jmo; MLS001360518; SCHEMBL504765; DTXSID2063347; 1,10-Phenanthroline,5-chloro-; 5-Chloro-[1,10]phenanthroline; CTK4I5525; KS-00000VIG; HMS3074N22; ZINC120457; ANW-29710; BDBM50401344; SBB008907; AKOS003369128; 5-Chloro-1,10-phenanthroline, 98%; CS-W004567; MCULE-5288776348; QC-5284; NCGC00247286-01; AK142130; AS-59329; SC-08540; SMR001223955; ST078006; FT-0714919; X3660
Click to Show/Hide
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||||
| Activity |
EC50 > 1000000 nM
|
[4] | |||
| Compound Name |
1,10-Phenanthroline-4,7-dicarbaldehyde
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2205801; 1,10-Phenanthroline-4,7-dicarboxaldehyde; SCHEMBL1088410; BDBM50401343; ZINC95558531; J-400085
Click to Show/Hide
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| Activity |
IC50 > 1000000 nM
|
[4] | |||
| Compound Name |
4'-Chloro-2,2':6',2''-terpyridine
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
4-chloro-2,6-dipyridin-2-ylpyridine; 4-Chloro-2,2:6,2-Terpyridine; MFCD00191930; 4'-Chloro-2,2':6',2'-terpyridine; 4'-Chloro-2,2',6',2''-Terpyridine; 2,2':6',2''-Terpyridine, 4'-chloro-; CHEMBL2205805; 4'-Chloro-2,2':6',2''-terpyridine, 99%; 4-chloro-2,6-di(2-pyridyl)pyridine; zlchem 975; 4'-Chloro-2,2'6'2''-Terpyridine; ACMC-1CG8D; SCHEMBL517337; CTK8C5880; KS-00001KND; ZINC27093; DTXSID00349885; ZLD0441; BDBM50401354; SBB012477; AKOS015891546; 4-Chloro-2,6-bis(2-pyridyl)pyridine; CS-W004586; MCULE-4261236661; 4'-Chloro-[2,2'6',2']Terpyridine; 4-chloro-2,6-bis(2-pyridinyl)pyridine; KS-00000X34; 4'-chloro-2,2';6',2''-terpyridine; 4'-chloro-2.2':6'.2''-terpyridine; 4-chloranyl-2,6-dipyridin-2-yl-pyridine; AK135157; AS-19986; ST069343; SY050155; 4'-chloro-[2,2';6',2'']terpyridine; 4'-Chloro-2,2' : 6',2'-terpyridine; 4'-chloro-2,2':6',2''-terpy-ridine; 4'-chloro-[2,2';6',2'']-terpyridine; 4'-Chloro-alpha,alpha',alpha''-tripyridyl; FT-0617991; Z3119; A805791; J-400573
Click to Show/Hide
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||||
| Activity |
EC50 > 1000000 nM
|
[4] | |||
| Compound Name |
4-[4-[[(3R)-3-[(R)-Cyclohexyl(hydroxy)methyl]-2,5-dioxo-1-(2,2,2-trifluoroethyl)-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]-N-methylbenzamide;hydrochloride
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1813457; SCHEMBL6189043
Click to Show/Hide
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||||
| Activity |
IC50 = 1148000 nM
|
[3] | |||
| Compound Name |
4,4'-Dimethoxy-2,2'-bipyridine
Click to Show/Hide
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Investigative | Compound Info | ||
| Synonyms |
4,4'-Dimethoxy-2,2'-bipyridyl; 4-methoxy-2-(4-methoxypyridin-2-yl)pyridine; 4,4'-Dimethoxy-[2,2']bipyridinyl; 2,2'-Bipyridine, 4,4'-dimethoxy-; CHEMBL2205808; MFCD00233880; MeO-bpy; 4-4'-Dimethoxy-2-2'-bipyridine; ACMC-1C6X1; SCHEMBL182529; CTK0I3310; DTXSID50370043; ZINC403962; KS-000002EK; 4,4'-dimethoxy-2,2'- bipyridine; ANW-22557; BDBM50401349; AKOS015851874; CS-W004762; VP14604; AC-20760; AK-63314; DS-15216; SC-65740; SY038948; 4-4'-Dimethoxy-2-2'-bipyridine, 97%; D3886; FT-0647788; ST50405823; 4-methoxy-2-(4-methoxy(2-pyridyl))pyridine; 4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine; A811383
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||||
| Activity |
IC50 = 1511000 nM
|
[4] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Design, synthesis and biological evaluation of caffeoyl benzanilides as dual inhibitors of HIV integrase and CCR5. Medchemcomm. 2016;7:2028-32. | ||||
| REF 2 | Design, syntheses, and characterization of piperazine based chemokine receptor CCR5 antagonists as anti prostate cancer agents. Bioorg Med Chem Lett. 2014 May 15;24(10):2319-23. | ||||
| REF 3 | Discovery of 4-[4-({(3R)-1-butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undec-9-yl}methyl)phenoxy]benzoic acid hydrochloride: a highly potent orally available CCR5 selective antagonist. Bioorg Med Chem. 2011 Jul 1;19(13):4028-42. | ||||
| REF 4 | Modulation in selectivity and allosteric properties of small-molecule ligands for CC-chemokine receptors. J Med Chem. 2012 Sep 27;55(18):8164-77. | ||||
| REF 5 | Design, syntheses, and characterization of pharmacophore based chemokine receptor CCR5 antagonists as anti prostate cancer agents. Eur J Med Chem. 2013 Nov;69:647-58. | ||||
| REF 6 | Isolation and structure of antagonists of chemokine receptor (CCR5). J Nat Prod. 2004 Jun;67(6):1036-8. | ||||
| REF 7 | Exploration on natural product anibamine side chain modification toward development of novel CCR5 antagonists and potential anti-prostate cancer agents. Bioorg Med Chem Lett. 2015 Sep 1;25(17):3721-5. | ||||
| REF 8 | Pyrazolo-Piperidines Exhibit Dual Inhibition of CCR5/CXCR4 HIV Entry and Reverse Transcriptase. ACS Med Chem Lett. 2015 May 6;6(7):753-7. | ||||
| REF 9 | Identification of nonpeptide CCR5 receptor agonists by structure-based virtual screening. J Med Chem. 2007 Mar 22;50(6):1294-303. | ||||
| REF 10 | 10-Methoxydihydrofuscin, fuscinarin, and fuscin, novel antagonists of the human CCR5 receptor from Oidiodendron griseum. J Nat Prod. 2003 Aug;66(8):1116-7. | ||||
| REF 11 | Syntheses and biological evaluation of 5-(piperidin-1-yl)-3-phenyl-pentylsulfones as CCR5 antagonists. Bioorg Med Chem Lett. 2004 Jul 5;14(13):3589-93. | ||||
| REF 12 | Structure activity relationship studies of natural product chemokine receptor CCR5 antagonist anibamine toward the development of novel anti prostate cancer agents. Eur J Med Chem. 2012 Sep;55:395-408. | ||||
| REF 13 | The potential role of anibamine, a natural product CCR5 antagonist, and its analogues as leads toward development of anti-ovarian cancer agents. Bioorg Med Chem Lett. 2012 Aug 1;22(15):5093-7. | ||||
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