BDBM50119659 (R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pyrrolidin-1-yl-6,7-dihydro-5H-[1]pyrindine-6-carboxylic acid::CHEMBL102173

SMILES: COc1ccc(cc1)[C@H]1[C@@H]([C@H](c2ccc(nc12)N1CCCC1)c1ccc2OCOc2c1)C(O)=O

InChI Key: InChIKey=HAIMYEQNXQUSSG-CCDWMCETSA-N

Data: 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 2 hits for monomerid = 50119659   

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
EDNRB (Homo sapiens (Human))	BDBM50119659 ((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...) Show SMILES COc1ccc(cc1)[C@H]1[C@@H]([C@H](c2ccc(nc12)N1CCCC1)c1ccc2OCOc2c1)C(O)=O Show InChI InChI=1S/C27H26N2O5/c1-32-18-7-4-16(5-8-18)24-25(27(30)31)23(17-6-10-20-21(14-17)34-15-33-20)19-9-11-22(28-26(19)24)29-12-2-3-13-29/h4-11,14,23-25H,2-3,12-13,15H2,1H3,(H,30,31)/t23-,24-,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin B receptor				Bioorg Med Chem Lett 12: 3041-5 (2002) BindingDB Entry DOI: 10.7270/Q2KK9B3N
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50119659 ((R)-5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2...) Show SMILES COc1ccc(cc1)[C@H]1[C@@H]([C@H](c2ccc(nc12)N1CCCC1)c1ccc2OCOc2c1)C(O)=O Show InChI InChI=1S/C27H26N2O5/c1-32-18-7-4-16(5-8-18)24-25(27(30)31)23(17-6-10-20-21(14-17)34-15-33-20)19-9-11-22(28-26(19)24)29-12-2-3-13-29/h4-11,14,23-25H,2-3,12-13,15H2,1H3,(H,30,31)/t23-,24-,25+/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inhibitory activity of the compound against I-labeled ET-1 binding to Endothelin A receptor				Bioorg Med Chem Lett 12: 3041-5 (2002) BindingDB Entry DOI: 10.7270/Q2KK9B3N
					More data for this Ligand-Target Pair