BDBM50320475 1-(2-(1-(2,5-difluorophenethyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethyl)-3-(2-methylquinolin-4-yl)urea::CHEMBL1163360

SMILES: COc1cc2CCN(CCNC(=O)Nc3cc(C)nc4ccccc34)C(CCc3cc(F)ccc3F)c2cc1OC

InChI Key: InChIKey=QOASOYQYNFSWQE-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 = 50320475   

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
Urotensin II receptor (Homo sapiens (Human))	BDBM50320475 (1-(2-(1-(2,5-difluorophenethyl)-6,7-dimethoxy-3,4-...) Show SMILES COc1cc2CCN(CCNC(=O)Nc3cc(C)nc4ccccc34)C(CCc3cc(F)ccc3F)c2cc1OC Show InChI InChI=1S/C32H34F2N4O3/c1-20-16-28(24-6-4-5-7-27(24)36-20)37-32(39)35-13-15-38-14-12-21-18-30(40-2)31(41-3)19-25(21)29(38)11-8-22-17-23(33)9-10-26(22)34/h4-7,9-10,16-19,29H,8,11-15H2,1-3H3,(H2,35,36,37,39)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development Curated by ChEMBL					Assay Description Binding affinity to human urotensin 2 receptor				J Med Chem 53: 2695-708 (2010) Article DOI: 10.1021/jm901294u BindingDB Entry DOI: 10.7270/Q20G3K9N
					More data for this Ligand-Target Pair