Drug Information

Drug General Information
Drug ID
D0GC7S
Former ID
DNC006768
Drug Name
1-phenyl-3-(3-(pyridin-2-yl)isoquinolin-1-yl)urea
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528290]
Formula
C21H16N4O
Canonical SMILES
C1=CC=C(C=C1)NC(=O)NC2=NC(=CC3=CC=CC=C32)C4=CC=CC=N4
InChI
1S/C21H16N4O/c26-21(23-16-9-2-1-3-10-16)25-20-17-11-5-4-8-15(17)14-19(24-20)18-12-6-7-13-22-18/h1-14H,(H2,23,24,25,26)
InChIKey
IJXVHHOSRPNGFG-UHFFFAOYSA-N
PubChem Compound ID
10640891
Target and Pathway
Target(s) Adenosine A3 receptor Target Info Inhibitor [528290]
Reactome Adenosine P1 receptors
G alpha (i) signalling events
WikiPathways Nucleotide GPCRs
GPCRs, Class A Rhodopsin-like
GPCRs, Other
References
Ref 528290J Med Chem. 2006 Jul 13;49(14):4085-97.Pharmacophore based receptor modeling: the case of adenosine A3 receptor antagonists. An approach to the optimization of protein models.
Ref 528290J Med Chem. 2006 Jul 13;49(14):4085-97.Pharmacophore based receptor modeling: the case of adenosine A3 receptor antagonists. An approach to the optimization of protein models.