Drug Information

Drug General Information
Drug ID
D0D2MA
Former ID
DIB019116
Drug Name
CGP42112
Synonyms
CGP 42112; CGP 42112A
Drug Type
Small molecular drug
Indication Discovery agent Investigative [540566]
Structure
Download
2D MOL
Formula
C52H69N13O11
InChI
InChI=1S/C52H69N13O11/c1-3-32(2)43(50(73)74)64-48(71)42-17-11-25-65(42)49(72)41(27-36-29-56-31-59-36)62-46(69)39(60-47(70)40(26-33-18-20-37(66)21-19-33)61-44(67)35-14-9-22-55-28-35)15-7-8-23-57-45(68)38(16-10-24-58-51(53)54)63-52(75)76-30-34-12-5-4-6-13-34/h4-6,9,12-14,18-22,28-29,31-32,38-43,66H,3,7-8,10-11,15-17,23-27,30H2,1-2H3,(H,56,59)(H,57,68)(H,60,70)(H,61,67)(H,62,69)(H,63,75)(H,64,71)(H,73,74)(H4,53,54,58)/t32-,38-,39-,40-,41-,42-,43-/m0/s1
InChIKey
UXGNARZDONUMMK-LRMQDCNJSA-N
PubChem Compound ID
123794
PubChem Substance ID
7978905, 24846623, 24892424, 29303986, 48179667, 48329014, 50067356, 50112613, 53790742, 57340583, 77186221, 91688838, 104419335, 135079629, 135652503, 162228079, 178100771, 240466291, 241376006, 242480678, 252156619, 252478179
Target and Pathway
Target(s) Type-2 angiotensin II receptor Target Info Agonist [531462]
KEGG Pathway Neuroactive ligand-receptor interaction
Adrenergic signaling in cardiomyocytes
Renin-angiotensin system
Reactome Peptide ligand-binding receptors
G alpha (i) signalling events
WikiPathways ACE Inhibitor Pathway
GPCRs, Class A Rhodopsin-like
Peptide GPCRs
GPCR ligand binding
GPCR downstream signaling
References
Ref 540566(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: 3944).
Ref 531462Relative affinity of angiotensin peptides and novel ligands at AT1 and AT2 receptors. Clin Sci (Lond). 2011 Oct;121(7):297-303.

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