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BDBM50126262 2-[5-(6-Cyano-pyridine-3-carbonyl)-1-methyl-1H-pyrrol-2-yl]-N-[2,4-dimethyl-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-N-methyl-acetamide::CHEMBL25751

SMILES: CN(C(=O)Cc1ccc(C(=O)c2ccc(nc2)C#N)n1C)c1ccc(C)c(COc2cccc3ccc(C)nc23)c1C

InChI Key: InChIKey=MOPYSGIIGCJHBN-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50126262   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
BDKRB2


(Homo sapiens (Human))		BDBM50126262
PNG
(2-[5-(6-Cyano-pyridine-3-carbonyl)-1-methyl-1H-pyr...)
Show SMILES CN(C(=O)Cc1ccc(C(=O)c2ccc(nc2)C#N)n1C)c1ccc(C)c(COc2cccc3ccc(C)nc23)c1C
Show InChI InChI=1S/C34H31N5O3/c1-21-9-15-29(23(3)28(21)20-42-31-8-6-7-24-11-10-22(2)37-33(24)31)39(5)32(40)17-27-14-16-30(38(27)4)34(41)25-12-13-26(18-35)36-19-25/h6-16,19H,17,20H2,1-5H3
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 103n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Binding affinity towards human bradykinin receptor B2

Bioorg Med Chem Lett 13: 1341-4 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57T1
More data for this
Ligand-Target Pair