TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T31391 Dipeptidyl peptidase 4 D08PUW BAICALIN Terminated 64982 C21H18O11 446.4 C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O)O IC50 = 225000 nM Non binder T31391 Dipeptidyl peptidase 4 B01DZW Isoindolin-2-yl((2S,4R)-4-(naphthalen-2-ylamino)pyrrolidin-2-yl)methanone Investigative 44560750 C23H23N3O 357.4 C1[C@H](CN[C@@H]1C(=O)N2CC3=CC=CC=C3C2)NC4=CC5=CC=CC=C5C=C4 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B0B6YP 2,6-Diamino-1-thiazolidin-3-yl-hexan-1-one Investigative 44364298 C9H19N3OS 217.33 C1CSCN1C(=O)C(CCCCN)N IC50 = 318000 nM Non binder T31391 Dipeptidyl peptidase 4 B0RX3J (2S,4S)-4-(4-Chlorobenzylamino)-2-amino-1-(piperidin-1-yl)pentan-1-one Investigative 16046127 C17H26ClN3O 323.9 C[C@@H](C[C@@H](C(=O)N1CCCCC1)N)NCC2=CC=C(C=C2)Cl IC50 = 325000 nM Non binder T31391 Dipeptidyl peptidase 4 B0Z3JL 2-(S)-Amino-4-(3-methoxy-benzylamino)-1-piperidin-1-yl-butan-1-one Investigative 11220471 C17H27N3O2 305.4 COC1=CC=CC(=C1)CNCC[C@@H](C(=O)N2CCCCC2)N IC50 = 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B15SMO (R)-1-(4-Oxo-4-phenylbutanoyl)pyrrolidin-2-ylboronic acid Investigative 44418253 C14H18BNO4 275.11 B([C@@H]1CCCN1C(=O)CCC(=O)C2=CC=CC=C2)(O)O Ki = 451000 nM Non binder T31391 Dipeptidyl peptidase 4 B16KXF (S)-2-Amino-1-(pyrrolidine-1-yl)-3-(1H-indole-3-yl)propane-1-one Investigative 10780092 C15H19N3O 257.329 C1CCN(C1)C(=O)[C@H](CC2=CNC3=CC=CC=C32)N IC50 = 286000 nM Non binder T31391 Dipeptidyl peptidase 4 B2BF5P 2-Amino-1-piperidin-1-yl-butan-1-one Investigative 12742483 C9H18N2O 170.25 CCC(C(=O)N1CCCCC1)N IC50 = 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B2HG8W 2,6-Diamino-1-(3,6-dihydro-2H-pyridin-1-yl)-hexan-1-one Investigative 44364231 C11H21N3O 211.3 C1CN(CC=C1)C(=O)C(CCCCN)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B2N3MR 2,6-Diamino-1-azetidin-1-yl-hexan-1-one Investigative 44364211 C9H19N3O 185.27 C1CN(C1)C(=O)C(CCCCN)N IC50 = 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B2NSL8 Fluoro-Olefin Analogue 10 Investigative 23646089 C18H28FN 277.4 C1CCC(=C(CNC23CC4CC(C2)CC(C4)C3)F)CC1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B2P5LC (2S)-2,6-Diamino-1-(3-hydroxypyrrolidin-1-yl)hexan-1-one Investigative 11310450 C10H21N3O2 215.29 C1CN(CC1O)C(=O)[C@H](CCCCN)N IC50 = 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B2X8FJ (S)-2-Amino-4-(4-chloro-benzylamino)-1-(2-methyl-piperidin-1-yl)-butan-1-one Investigative 11359214 C17H26ClN3O 323.9 CC1CCCCN1C(=O)[C@H](CCNCC2=CC=C(C=C2)Cl)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B38GKD (2H-1,3-Benzodioxol-5-ylmethyl)(2-cyclopentylideneethyl)amine Investigative 11207320 C15H19NO2 245.32 C1CCC(=CCNCC2=CC3=C(C=C2)OCO3)C1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B39QDU N-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butyl)-acetamide Investigative 10353699 C11H21N3O2 227.3 CC(=O)NCC[C@@H](C(=O)N1CCCCC1)N IC50 = 518000 nM Non binder T31391 Dipeptidyl peptidase 4 B3DCW5 2-(S)-Amino-4-(3-phenyl-propylamino)-1-piperidin-1-yl-butan-1-one Investigative 11312733 C18H29N3O 303.4 C1CCN(CC1)C(=O)[C@H](CCNCCCC2=CC=CC=C2)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B3E1DF 1H-Isoindole-1,3(2H)-dione, 5-amino-2-[2,6-bis(1-methylethyl)phenyl]- Investigative 1235479 C20H22N2O2 322.4 CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C3=C(C2=O)C=C(C=C3)N IC50 = 251200 nM Non binder T31391 Dipeptidyl peptidase 4 B3F0TL 2-Amino-1-piperidin-1-yl-hexan-1-one Investigative 44364102 C11H22N2O 198.31 CCCCC(C(=O)N1CCCCC1)N IC50 = 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B3REA8 2-Amino-1-azepan-1-yl-3-methyl-pentan-1-one Investigative 24704198 C12H24N2O 212.33 CCC(C)C(C(=O)N1CCCCCC1)N IC50 = 374000 nM Non binder T31391 Dipeptidyl peptidase 4 B3RLF8 (S)-2-Amino-4-phenylamino-1-piperidin-1-yl-butan-1-one Investigative 11436930 C15H23N3O 261.36 C1CCN(CC1)C(=O)[C@H](CCNC2=CC=CC=C2)N IC50 = 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B57KRT 4-Hydroxy-2-(2-methylsulfanyl-phenyl)-isoindole-1,3-dione Investigative 44368725 C15H11NO3S 285.3 CSC1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=CC=C3)O IC50 = 225700 nM Non binder T31391 Dipeptidyl peptidase 4 B5WSV7 2-(2,6-Dimethylphenyl)-4-nitro-1H-isoindole-1,3(2H)-dione Investigative 721814 C16H12N2O4 296.28 CC1=C(C(=CC=C1)C)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] IC50 > 337500 nM Non binder T31391 Dipeptidyl peptidase 4 B67IAM Fluoro-Olefin Analogue 9 Investigative 23646088 C14H24FN 225.35 C1CCC(CC1)NCC(=C2CCCCC2)F IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B69EXM (2S,4R)-4-(4-Chlorobenzylamino)-2-amino-5-methyl-1-(piperidin-1-yl)heptan-1-one Investigative 44415929 C20H32ClN3O 365.9 CCC(C)[C@@H](C[C@@H](C(=O)N1CCCCC1)N)NCC2=CC=C(C=C2)Cl IC50 = 234000 nM Non binder T31391 Dipeptidyl peptidase 4 B6F0CW Benzyl N-[(2S)-6-amino-1-[1-bis(4-acetamidophenoxy)phosphoryl-1,3-dihydroisoindol-2-yl]-1-oxohexan-2-yl]carbamate Investigative 44435316 C38H42N5O8P 727.7 CC(=O)NC1=CC=C(C=C1)OP(=O)(C2C3=CC=CC=C3CN2C(=O)[C@H](CCCCN)NC(=O)OCC4=CC=CC=C4)OC5=CC=C(C=C5)NC(=O)C IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B6FG7V 1-(Aminomethyl)-6,7-dimethoxyisoquinoline-4-carbaldehyde;hydrochloride Investigative 45259892 C13H15ClN2O3 282.72 COC1=C(C=C2C(=C1)C(=CN=C2CN)C=O)OC.Cl IC50 = 277000 nM Non binder T31391 Dipeptidyl peptidase 4 B6QYR2 2-(2,6-Dimethyl-phenyl)-4-hydroxy-isoindole-1,3-dione Investigative 10492044 C16H13NO3 267.28 CC1=C(C(=CC=C1)C)N2C(=O)C3=C(C2=O)C(=CC=C3)O IC50 > 374100 nM Non binder T31391 Dipeptidyl peptidase 4 B76FGO 2-(S)-Amino-4-(cyclohexylmethyl-amino)-1-piperidin-1-yl-butan-1-one Investigative 11266019 C16H31N3O 281.44 C1CCC(CC1)CNCC[C@@H](C(=O)N2CCCCC2)N IC50 = 496000 nM Non binder T31391 Dipeptidyl peptidase 4 B7GH2J 1H-Isoindole-1,3(2H)-dione, 2-[2,6-bis(1-methylethyl)phenyl]-4-nitro- Investigative 20038035 C20H20N2O4 352.4 CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] IC50 > 283800 nM Non binder T31391 Dipeptidyl peptidase 4 B83VKR 2,4-Diamino-1-thiazolidin-3-yl-butan-1-one Investigative 44364296 C7H15N3OS 189.28 C1CSCN1C(=O)C(CCN)N IC50 = 289000 nM Non binder T31391 Dipeptidyl peptidase 4 B84QWX (S)-2-Amino-4-(4-chloro-benzylamino)-1-(3-methyl-piperidin-1-yl)-butan-1-one Investigative 11381726 C17H26ClN3O 323.9 CC1CCCN(C1)C(=O)[C@H](CCNCC2=CC=C(C=C2)Cl)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B8BJ7Z Fluoro-Olefin Analogue 11 Investigative 23646090 C14H18FN 219.3 C1CCC(=C(CNC2=CC=CC=C2)F)CC1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 B8KRP1 Ethyl 1-[(dimethylamino)methyl]-6,7-dimethoxyisoquinoline-4-carboxylate;hydrochloride Investigative 45259934 C17H23ClN2O4 354.8 CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CN(C)C.Cl IC50 = 948000 nM Non binder T31391 Dipeptidyl peptidase 4 B8R6TU 2-(2,6-Dimethylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione Investigative 477696 C16H12N2O4 296.28 CC1=C(C(=CC=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-] IC50 > 337500 nM Non binder T31391 Dipeptidyl peptidase 4 B8YTM3 (S)-2-Amino-4-(4-chloro-benzylamino)-1-(4-methyl-piperidin-1-yl)-butan-1-one Investigative 10403949 C17H26ClN3O 323.9 CC1CCN(CC1)C(=O)[C@H](CCNCC2=CC=C(C=C2)Cl)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B94NMG Ethyl 1-(aminomethyl)-6-methoxyisoquinoline-4-carboxylate;hydrochloride Investigative 45259946 C14H17ClN2O3 296.75 CCOC(=O)C1=CN=C(C2=C1C=C(C=C2)OC)CN.Cl IC50 = 207000 nM Non binder T31391 Dipeptidyl peptidase 4 B95RMJ 2-Amino-3-methyl-pentanoic acid diethylamide Investigative 17763521 C10H22N2O 186.29 CCC(C)C(C(=O)N(CC)CC)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B9OEH4 ((2S,4R)-4-(Dibenzylamino)pyrrolidin-2-yl)(isoindolin-2-yl)methanone Investigative 44560749 C27H29N3O 411.5 C1[C@H](CN[C@@H]1C(=O)N2CC3=CC=CC=C3C2)N(CC4=CC=CC=C4)CC5=CC=CC=C5 IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 B9QY7C (2S)-2-Amino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-(1H-imidazol-4-yl)propan-1-one Investigative 11037548 C22H25N4O4P 440.4 C1CC(N(C1)C(=O)[C@H](CC2=CN=CN2)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4 IC50 = 326000 nM Non binder T31391 Dipeptidyl peptidase 4 B9XQ2Z 2,6-Diamino-1-(3-hydroxy-pyrrolidin-1-yl)-hexan-1-one Investigative 44364458 C10H21N3O2 215.29 C1CN(CC1O)C(=O)C(CCCCN)N IC50 = 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BA5S7T 2-(S)-Amino-4-benzylamino-1-piperidin-1-yl-butan-1-one Investigative 9817010 C16H25N3O 275.39 C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=CC=C2)N IC50 = 247000 nM Non binder T31391 Dipeptidyl peptidase 4 BB02TU Benzoic acid 1-(2-amino-3-methyl-pentanoyl)-pyrrolidin-3-yl ester Investigative 44364446 C17H24N2O3 304.4 CCC(C)C(C(=O)N1CCC(C1)OC(=O)C2=CC=CC=C2)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BB17VA N-(1,3-Benzodioxol-5-ylmethyl)-2-pyrrolidin-1-ylethanamine Investigative 42773972 C14H20N2O2 248.32 C1CCN(C1)CCNCC2=CC3=C(C=C2)OCO3 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BC2HX7 2-(S)-Amino-4-(2-methoxy-benzylamino)-1-piperidin-1-yl-butan-1-one Investigative 11150893 C17H27N3O2 305.4 COC1=CC=CC=C1CNCC[C@@H](C(=O)N2CCCCC2)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BC78BY (2S)-2-Amino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-hydroxy-propan-1-one Investigative 11731880 C19H23N2O5P 390.4 C1CC(N(C1)C(=O)[C@H](CO)N)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3 IC50 = 503000 nM Non binder T31391 Dipeptidyl peptidase 4 BE7KO5 Diphenyl 1-((S)-2,4-diaminobutanoyl)pyrrolidin-2-ylphosphonate Investigative 44435310 C20H26N3O4P 403.4 C1CC(N(C1)C(=O)[C@H](CCN)N)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3 IC50 = 261000 nM Non binder T31391 Dipeptidyl peptidase 4 BEGH78 2-(2,6-Diisopropyl-phenyl)-isoindole-1,3-dione Investigative 9995375 C20H21NO2 307.4 CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C3=CC=CC=C3C2=O IC50 > 325300 nM Non binder T31391 Dipeptidyl peptidase 4 BEV48M (2S,4R)-4-(4-Chlorobenzylamino)-2-amino-1-(piperidin-1-yl)pentan-1-one Investigative 44415883 C17H26ClN3O 323.9 C[C@H](C[C@@H](C(=O)N1CCCCC1)N)NCC2=CC=C(C=C2)Cl IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BF5B6S 2-(2-Methylsulfanyl-phenyl)-4-nitro-isoindole-1,3-dione Investigative 44368726 C15H10N2O4S 314.3 CSC1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] IC50 > 318200 nM Non binder T31391 Dipeptidyl peptidase 4 BF92CP (2S)-2-Amino-4-[(2,4-dimethoxyphenyl)methylamino]-1-piperidin-1-ylbutan-1-one Investigative 11473127 C18H29N3O3 335.4 COC1=CC(=C(C=C1)CNCC[C@@H](C(=O)N2CCCCC2)N)OC IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BF9NS8 1-(3-Cyclohexyl-propionyl)-pyrrolidine-2-carbonitrile Investigative 11117990 C14H22N2O 234.34 C1CCC(CC1)CCC(=O)N2CCC[C@H]2C#N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BFD8C9 2-[(Z)-1-Fluoro-2-(phenethylamino)ethylidene]cyclopentanecarbonitrile Investigative 10872395 C16H19FN2 258.329 C1CC(/C(=C(/CNCCC2=CC=CC=C2)\\F)/C1)C#N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BFQW09 Di-(4-acetamido)phenyl 2-((S)-2,6-diaminohexanoyl)isoindolin-1-ylphosphonate Investigative 23655476 C30H36N5O6P 593.6 CC(=O)NC1=CC=C(C=C1)OP(=O)(C2C3=CC=CC=C3CN2C(=O)[C@H](CCCCN)N)OC4=CC=C(C=C4)NC(=O)C IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BG1A7R Fluoro-Olefin Analogue 7 Investigative 23646086 C19H27FN2 302.4 C1CCC(=C(CNC2CCN(CC2)CC3=CC=CC=C3)F)C1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BG3U9D ((2S,4S)-4-(Benzylamino)pyrrolidin-2-yl)(isoindolin-2-yl)methanone Investigative 44560698 C20H23N3O 321.4 C1[C@@H](CN[C@@H]1C(=O)N2CC3=CC=CC=C3C2)NCC4=CC=CC=C4 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BGL49M (S)-2-Amino-4-dibenzylamino-1-piperidin-1-yl-butan-1-one Investigative 11474019 C23H31N3O 365.5 C1CCN(CC1)C(=O)[C@H](CCN(CC2=CC=CC=C2)CC3=CC=CC=C3)N IC50 = 266000 nM Non binder T31391 Dipeptidyl peptidase 4 BH6XL1 (2H-1,3-Benzodioxol-5-ylmethyl)(2-cyclohexylidene-2-fluoroethyl)amine Investigative 23646093 C16H20FNO2 277.33 C1CCC(=C(CNCC2=CC3=C(C=C2)OCO3)F)CC1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BHDS65 2-Amino-3-methyl-pentanoic acid methyl-propyl-amide Investigative 43271345 C10H22N2O 186.29 CCCN(C)C(=O)C(C(C)CC)N IC50 = 377000 nM Non binder T31391 Dipeptidyl peptidase 4 BJ14VB 2-Amino-2-cyclohexyl-1-piperidin-1-yl-ethanone Investigative 44364133 C13H24N2O 224.34 C1CCC(CC1)C(C(=O)N2CCCCC2)N IC50 = 217000 nM Non binder T31391 Dipeptidyl peptidase 4 BJ6E4F N-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butyl)-benzamide Investigative 11300739 C16H23N3O2 289.37 C1CCN(CC1)C(=O)[C@H](CCNC(=O)C2=CC=CC=C2)N IC50 = 418000 nM Non binder T31391 Dipeptidyl peptidase 4 BJ7QB3 2,5-Diamino-1-piperidin-1-yl-pentan-1-one Investigative 10081481 C10H21N3O 199.29 C1CCN(CC1)C(=O)C(CCCN)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BJAF95 Diphenyl 2-((2S,3S)-2-amino-3-methylpentanoyl)isoindolin-1-ylphosphonate Investigative 23657402 C26H29N2O4P 464.5 CC[C@H](C)[C@@H](C(=O)N1CC2=CC=CC=C2C1P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)N IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BJN02P 2-Amino-1-piperidin-1-yl-pentan-1-one Investigative 43650152 C10H20N2O 184.28 CCCC(C(=O)N1CCCCC1)N IC50 = 229000 nM Non binder T31391 Dipeptidyl peptidase 4 BK1T6Y (2S)-2-Amino-4-(naphthalen-1-ylmethylamino)-1-piperidin-1-ylbutan-1-one Investigative 11209569 C20H27N3O 325.4 C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=CC3=CC=CC=C32)N IC50 = 301000 nM Non binder T31391 Dipeptidyl peptidase 4 BL0B8W 2,4-Diamino-1-piperidin-1-yl-butan-1-one Investigative 24906298 C9H19N3O 185.27 C1CCN(CC1)C(=O)C(CCN)N IC50 = 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BL67JA Pyrrolidin-1-yl-(tetrahydro-thiophen-2-yl)-methanone Investigative 44364227 C9H15NOS 185.29 C1CCN(C1)C(=O)C2CCCS2 IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BM4BI3 Pyrrolidin-2-yl-pyrrolidin-1-yl-methanethione Investigative 44328319 C9H16N2S 184.3 C1CCN(C1)C(=S)C2CCCN2 IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BM5FI2 1-Isoleucylhexahydro-1H-azepine Investigative 10798619 C12H24N2O 212.33 CC[C@H](C)[C@@H](C(=O)N1CCCCCC1)N IC50 = 374000 nM Non binder T31391 Dipeptidyl peptidase 4 BN5SP7 2,6-Dimethylphenylphthalimide Investigative 73324 C16H13NO2 251.28 CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3C2=O IC50 > 398000 nM Non binder T31391 Dipeptidyl peptidase 4 BNVL16 1-{2-[2-(5-Cyano-pyridin-2-ylamino)-ethylamino]-acetyl}-pyrrolidine-2-carboxylic acid amide Investigative 10980018 C15H20N6O2 316.36 C1C[C@H](N(C1)C(=O)CNCCNC2=NC=C(C=C2)C#N)C(=O)N IC50 = 434000 nM Non binder T31391 Dipeptidyl peptidase 4 BOD38Z (2E)-2-(1-Fluoro-2-{[(4-fluorophenyl)methyl]amino}ethylidene)cyclopentane-1-carbonitrile Investigative 11025199 C15H16F2N2 262.3 C1CC(/C(=C(\\CNCC2=CC=C(C=C2)F)/F)/C1)C#N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BOZ4X6 1-[2-(3-Hydroxy-adamantan-1-ylamino)-acetyl]-pyrrolidine-2-carboxylic acid amide Investigative 11067211 C17H27N3O3 321.4 C1C[C@H](N(C1)C(=O)CNC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)C(=O)N IC50 = 931000 nM Non binder T31391 Dipeptidyl peptidase 4 BP7X3Y 2,6-Diamino-1-piperidin-1-yl-hexan-1-one Investigative 18398588 C11H23N3O 213.32 C1CCN(CC1)C(=O)C(CCCCN)N IC50 = 247000 nM Non binder T31391 Dipeptidyl peptidase 4 BPG50Z 1-[2-(3-Hydroxy-adamantan-1-ylamino)-acetyl]-pyrrolidine-2-carboxylic acid Investigative 11023706 C17H26N2O4 322.4 C1C[C@H](N(C1)C(=O)CNC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)C(=O)O IC50 = 477000 nM Non binder T31391 Dipeptidyl peptidase 4 BPN25Z Fluoro-Olefin Analogue 19 Investigative 23646098 C20H29FN2 316.5 C1CCC(=C(CNC2CCN(CC2)CC3=CC=CC=C3)F)CC1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BQ67ZI Ethyl 6,7-dimethoxy-1-(methylaminomethyl)isoquinoline-4-carboxylate;hydrochloride Investigative 45259942 C16H21ClN2O4 340.8 CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CNC.Cl IC50 = 731000 nM Non binder T31391 Dipeptidyl peptidase 4 BR94VL 2-Cyclohexylamino-1-piperidin-1-yl-propan-1-one Investigative 10376940 C14H26N2O 238.37 C1CCC(CC1)C[C@@H](C(=O)N2CCCCC2)N IC50 = 217000 nM Non binder T31391 Dipeptidyl peptidase 4 BRC02F (2S)-2-Amino-1-piperidin-1-yl-4-(thiophen-2-ylmethylamino)butan-1-one Investigative 11312069 C14H23N3OS 281.42 C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=CS2)N IC50 = 278000 nM Non binder T31391 Dipeptidyl peptidase 4 BRF50K ((2S,4R)-4-Aminopyrrolidin-2-yl)(isoindolin-2-yl)methanone Investigative 44560747 C13H17N3O 231.29 C1[C@H](CN[C@@H]1C(=O)N2CC3=CC=CC=C3C2)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BRU6V0 (2-Cyclohexylidene-2-fluoroethyl)[(4-fluorophenyl)methyl]amine Investigative 23646094 C15H19F2N 251.31 C1CCC(=C(CNCC2=CC=C(C=C2)F)F)CC1 IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BS4GF2 (S)-1-(2-(3,4-Dihydroisoquinolin-2(1H)-yl)acetyl)pyrrolidine-2-carbonitrile Investigative 44580500 C16H19N3O 269.34 C1C[C@H](N(C1)C(=O)CN2CCC3=CC=CC=C3C2)C#N IC50 = 390000 nM Non binder T31391 Dipeptidyl peptidase 4 BSL12E 2-Amino-3-methyl-pentanoic acid dimethylamide Investigative 24710701 C8H18N2O 158.24 CCC(C)C(C(=O)N(C)C)N IC50 = 360000 nM Non binder T31391 Dipeptidyl peptidase 4 BT3E5L N-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butyl)-guanidine Investigative 10059633 C10H21N5O 227.31 C1CCN(CC1)C(=O)[C@H](CCN=C(N)N)N IC50 = 545000 nM Non binder T31391 Dipeptidyl peptidase 4 BTGU28 (S)-4-(4-Chloro-benzylamino)-2-methylamino-1-piperidin-1-yl-butan-1-one Investigative 11472776 C17H26ClN3O 323.9 CN[C@@H](CCNCC1=CC=C(C=C1)Cl)C(=O)N2CCCCC2 IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BU7F9X 1H-Isoindole-1,3(2H)-dione, 2-[2,6-bis(1-methylethyl)phenyl]-5-nitro- Investigative 13784835 C20H20N2O4 352.4 CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-] IC50 > 283800 nM Non binder T31391 Dipeptidyl peptidase 4 BUYS91 (S)-Benzyl 5-amino-6-(isoindolin-2-yl)-6-oxohexylcarbamate Investigative 44593409 C22H27N3O3 381.5 C1C2=CC=CC=C2CN1C(=O)[C@H](CCCCNC(=O)OCC3=CC=CC=C3)N IC50 = 245000 nM Non binder T31391 Dipeptidyl peptidase 4 BV2N9S Ethyl 1-(2-aminoethyl)-6,7-dimethoxyisoquinoline-4-carboxylate;2,2,2-trifluoroacetic acid Investigative 44286479 C18H21F3N2O6 418.4 CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CCN.C(=O)(C(F)(F)F)O IC50 = 746000 nM Non binder T31391 Dipeptidyl peptidase 4 BVB19K (S)-2-Amino-4-(4-chloro-benzylamino)-1-(3-fluoro-piperidin-1-yl)-butan-1-one Investigative 11450266 C16H23ClFN3O 327.82 C1CC(CN(C1)C(=O)[C@H](CCNCC2=CC=C(C=C2)Cl)N)F IC50 = 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BWK38T (R)-1-(2-Pivalamidoacetyl)pyrrolidin-2-ylboronic acid Investigative 15951928 C11H21BN2O4 256.11 B([C@@H]1CCCN1C(=O)CNC(=O)C(C)(C)C)(O)O Ki = 608000 nM Non binder T31391 Dipeptidyl peptidase 4 BWL13O N-[4-[(4-Acetamidophenoxy)-[2-[(2S,3R)-2-amino-3-methylpentanoyl]-1,3-dihydroisoindol-1-yl]phosphoryl]oxyphenyl]acetamide Investigative 23657547 C30H35N4O6P 578.6 CC[C@@H](C)[C@@H](C(=O)N1CC2=CC=CC=C2C1P(=O)(OC3=CC=C(C=C3)NC(=O)C)OC4=CC=C(C=C4)NC(=O)C)N IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BX8ZL1 2-(S)-Amino-4-(4-methoxy-benzylamino)-1-piperidin-1-yl-butan-1-one Investigative 11255193 C17H27N3O2 305.4 COC1=CC=C(C=C1)CNCC[C@@H](C(=O)N2CCCCC2)N IC50 = 417000 nM Non binder T31391 Dipeptidyl peptidase 4 BXG5J0 Ubenimex Investigative 72172 C16H24N2O4 308.37 CC(C)C[C@@H](C(=O)O)NC(=O)[C@H]([C@@H](CC1=CC=CC=C1)N)O IC50 > 324300 nM Non binder T31391 Dipeptidyl peptidase 4 BY96WI (2S)-2-Amino-4-[(2-phenylmethoxyphenyl)methylamino]-1-piperidin-1-ylbutan-1-one Investigative 11383468 C23H31N3O2 381.5 C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=CC=C2OCC3=CC=CC=C3)N IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 BZ1T7H 6-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butylamino)-nicotinonitrile Investigative 11289193 C15H21N5O 287.36 C1CCN(CC1)C(=O)[C@H](CCNC2=NC=C(C=C2)C#N)N IC50 = 205000 nM Non binder T31391 Dipeptidyl peptidase 4 BZ5A9C (2-Cyclohexylidene-2-fluoroethyl)[(4-methoxyphenyl)methyl]amine Investigative 23646092 C16H22FNO 263.35 COC1=CC=C(C=C1)CNCC(=C2CCCCC2)F IC50 > 250000 nM Non binder T31391 Dipeptidyl peptidase 4 BZ5RL3 2-Amino-3-(1H-imidazol-4-yl)-1-piperidin-1-yl-propan-1-one Investigative 44328318 C11H18N4O 222.29 C1CCN(CC1)C(=O)C(CC2=CN=CN2)N IC50 = 213000 nM Non binder T31391 Dipeptidyl peptidase 4 BZF76U Diphenyl 2-((S)-2,6-diaminohexanoyl)isoindolin-1-ylphosphonate Investigative 23655298 C26H30N3O4P 479.5 C1C2=CC=CC=C2C(N1C(=O)[C@H](CCCCN)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4 IC50 > 500000 nM Non binder T31391 Dipeptidyl peptidase 4 D00YEV BAICALEIN Investigative 5281605 C15H10O5 270.24 C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O IC50 > 200000 nM Non binder T31391 Dipeptidyl peptidase 4 D0JL2T 3,7-dihydroxy-flavone Investigative 5393152 C15H10O4 254.24 C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O IC50 > 200000 nM Non binder