BDBM20345 3-{[4-(azepan-1-yl)phenyl]methyl}-1-(3-methylisoquinolin-5-yl)urea::Isoquinoline Analogue, 39

SMILES: Cc1cc2c(NC(=O)NCc3ccc(cc3)N3CCCCCC3)cccc2cn1

InChI Key: InChIKey=CRXMYQXPWMGLMV-UHFFFAOYSA-N

Data: 1 EC50

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 = 20345   

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
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM20345 (3-{[4-(azepan-1-yl)phenyl]methyl}-1-(3-methylisoqu...) Show SMILES Cc1cc2c(NC(=O)NCc3ccc(cc3)N3CCCCCC3)cccc2cn1 Show InChI InChI=1S/C24H28N4O/c1-18-15-22-20(17-25-18)7-6-8-23(22)27-24(29)26-16-19-9-11-21(12-10-19)28-13-4-2-3-5-14-28/h6-12,15,17H,2-5,13-14,16H2,1H3,(H2,26,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.80	n/a	n/a	7.4	22
Abbott Laboratories					Assay Description The functional antagonist activity of compounds at the TRPV1 receptor was determined with a Ca2+ influx assay by measuring the effect on capsaicin (0...				J Med Chem 50: 3651-60 (2007) Article DOI: 10.1021/jm070276i BindingDB Entry DOI: 10.7270/Q2SJ1HWH
					More data for this Ligand-Target Pair