BDBM50302268 CHEMBL578206::N-((R)-4-(3,4-dimethoxyphenyl)-4-(1-oxo-4-(4-((R)-1-phenylethyl)piperazin-1-yl)isoindolin-2-yl)butyl)-5-methylisoxazole-4-carboxamide

SMILES: COc1ccc(cc1OC)[C@@H](CCCNC(=O)c1cnoc1C)N1Cc2c(cccc2N2CCN(CC2)[C@H](C)c2ccccc2)C1=O

InChI Key: InChIKey=WYGHIDQLPZLSFF-NLGDKJDOSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50302268   

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))	BDBM50302268 (CHEMBL578206 | N-((R)-4-(3,4-dimethoxyphenyl)-4-(1...) Show SMILES COc1ccc(cc1OC)[C@@H](CCCNC(=O)c1cnoc1C)N1Cc2c(cccc2N2CCN(CC2)[C@H](C)c2ccccc2)C1=O |r| Show InChI InChI=1S/C37H43N5O5/c1-25(27-10-6-5-7-11-27)40-18-20-41(21-19-40)33-13-8-12-29-31(33)24-42(37(29)44)32(28-15-16-34(45-3)35(22-28)46-4)14-9-17-38-36(43)30-23-39-47-26(30)2/h5-8,10-13,15-16,22-23,25,32H,9,14,17-21,24H2,1-4H3,(H,38,43)/t25-,32-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development Curated by ChEMBL					Assay Description Displacement of [125I]urotensin 2 from urotensin 2 receptor in human RMS13 cells by scintillation proximity assay				J Med Chem 52: 7432-45 (2009) Article DOI: 10.1021/jm900683d BindingDB Entry DOI: 10.7270/Q2S75GD7
					More data for this Ligand-Target Pair
Urotensin II receptor (Homo sapiens (Human))	BDBM50302268 (CHEMBL578206 | N-((R)-4-(3,4-dimethoxyphenyl)-4-(1...) Show SMILES COc1ccc(cc1OC)[C@@H](CCCNC(=O)c1cnoc1C)N1Cc2c(cccc2N2CCN(CC2)[C@H](C)c2ccccc2)C1=O |r| Show InChI InChI=1S/C37H43N5O5/c1-25(27-10-6-5-7-11-27)40-18-20-41(21-19-40)33-13-8-12-29-31(33)24-42(37(29)44)32(28-15-16-34(45-3)35(22-28)46-4)14-9-17-38-36(43)30-23-39-47-26(30)2/h5-8,10-13,15-16,22-23,25,32H,9,14,17-21,24H2,1-4H3,(H,38,43)/t25-,32-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development Curated by ChEMBL					Assay Description Antagonist activity at urotensin 2 receptor in human RMS13 cells assessed as inhibition of urotensin 2-induced intracellular calcium mobilization aft...				J Med Chem 52: 7432-45 (2009) Article DOI: 10.1021/jm900683d BindingDB Entry DOI: 10.7270/Q2S75GD7
					More data for this Ligand-Target Pair
UTS2R (RAT)	BDBM50302268 (CHEMBL578206 | N-((R)-4-(3,4-dimethoxyphenyl)-4-(1...) Show SMILES COc1ccc(cc1OC)[C@@H](CCCNC(=O)c1cnoc1C)N1Cc2c(cccc2N2CCN(CC2)[C@H](C)c2ccccc2)C1=O |r| Show InChI InChI=1S/C37H43N5O5/c1-25(27-10-6-5-7-11-27)40-18-20-41(21-19-40)33-13-8-12-29-31(33)24-42(37(29)44)32(28-15-16-34(45-3)35(22-28)46-4)14-9-17-38-36(43)30-23-39-47-26(30)2/h5-8,10-13,15-16,22-23,25,32H,9,14,17-21,24H2,1-4H3,(H,38,43)/t25-,32-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research& Development Curated by ChEMBL					Assay Description Antagonist activity at rat urotensin 2 receptor expressed in CHOK1 cells assessed as inhibition of urotensin 2-induced intracellular calcium mobiliza...				J Med Chem 52: 7432-45 (2009) Article DOI: 10.1021/jm900683d BindingDB Entry DOI: 10.7270/Q2S75GD7
					More data for this Ligand-Target Pair