BDBM50320819 CHEMBL1163808::N-(4-(3-(1-amino-2-methylpropan-2-ylcarbamoyl)phenyl)-3-cyano-6-(2-hydroxyphenyl)pyridin-2-yl)-2-methoxybenzamide

SMILES: COc1ccccc1C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NC(C)(C)CN)c1C#N)-c1ccccc1O

InChI Key: InChIKey=BPMGVPIXHROSEM-UHFFFAOYSA-N

Data: 1 IC50

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 = 50320819   

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
G-protein Coupled Receptor 54 (Homo sapiens (Human))	BDBM50320819 (CHEMBL1163808 | N-(4-(3-(1-amino-2-methylpropan-2-...) Show SMILES COc1ccccc1C(=O)Nc1nc(cc(-c2cccc(c2)C(=O)NC(C)(C)CN)c1C#N)-c1ccccc1O Show InChI InChI=1S/C31H29N5O4/c1-31(2,18-33)36-29(38)20-10-8-9-19(15-20)23-16-25(21-11-4-6-13-26(21)37)34-28(24(23)17-32)35-30(39)22-12-5-7-14-27(22)40-3/h4-16,37H,18,33H2,1-3H3,(H,36,38)(H,34,35,39)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]metastin(40-54) from human GPR54 receptor expressed in CHO cells after 60 mins by scintillation counting				Bioorg Med Chem 18: 3841-59 (2010) Article DOI: 10.1016/j.bmc.2010.04.036 BindingDB Entry DOI: 10.7270/Q22807S6
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