Drug Information

Drug General Information
Drug ID
D05VGC
Former ID
DIB019344
Drug Name
compound 21
Drug Type
Small molecular drug
Indication Discovery agent Investigative [531315], [541108]
Structure
Download
2D MOL
Formula
C18H20FN5O4
InChI
InChI=1S/C18H20FN5O4/c1-9-2-4-11(18(26)27)14(6-9)22-17(25)12(20)7-15-23-16(24-28-15)13-5-3-10(19)8-21-13/h3,5,8-9,12H,2,4,6-7,20H2,1H3,(H,22,25)(H,26,27)/t9-,12+/m1/s1
InChIKey
CDYGJIFOATYSNF-SKDRFNHKSA-N
PubChem Compound ID
53238781
PubChem Substance ID
124348135, 131283550, 131345456, 135629529, 178102414
Target and Pathway
Target(s) Nicotinic acid receptor 1 Target Info Agonist [531315]
KEGG Pathway cAMP signaling pathway
Reactome Class A/1 (Rhodopsin-like receptors)
G alpha (i) signalling events
WikiPathways GPCR ligand binding
GPCR downstream signaling
References
Ref 531315The discovery of high affinity agonists of GPR109a with reduced serum shift and improved ADME properties. Bioorg Med Chem Lett. 2011 May 1;21(9):2721-4.
Ref 541108(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5789).
Ref 531315The discovery of high affinity agonists of GPR109a with reduced serum shift and improved ADME properties. Bioorg Med Chem Lett. 2011 May 1;21(9):2721-4.

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