BDBM50329359 3-cyano-N-(6-(piperidine-1-carbonyl)-3-(pyridin-4-ylmethyl)-3H-imidazo[4,5-b]pyridin-2-yl)benzamide::CHEMBL1271325

SMILES: O=C(Nc1nc2cc(cnc2n1Cc1ccncc1)C(=O)N1CCCCC1)c1cccc(c1)C#N

InChI Key: InChIKey=CAZFIZMZKKSHOV-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50329359   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50329359 (3-cyano-N-(6-(piperidine-1-carbonyl)-3-(pyridin-4-...) Show SMILES O=C(Nc1nc2cc(cnc2n1Cc1ccncc1)C(=O)N1CCCCC1)c1cccc(c1)C#N Show InChI InChI=1S/C26H23N7O2/c27-15-19-5-4-6-20(13-19)24(34)31-26-30-22-14-21(25(35)32-11-2-1-3-12-32)16-29-23(22)33(26)17-18-7-9-28-10-8-18/h4-10,13-14,16H,1-3,11-12,17H2,(H,30,31,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]SCH58261 from human recombinant A2A receptor expressed in HEK293 cells				Bioorg Med Chem Lett 20: 6845-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.064 BindingDB Entry DOI: 10.7270/Q2NS0V4K
					More data for this Ligand-Target Pair