BDBM50119661 5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pentyl-6,7-dihydro-5H-[1]pyrindine-6-carboxylic acid::CHEMBL320208

SMILES: CCCCCc1ccc2[C@@H]([C@H]([C@@H](c2n1)c1ccc(OC)cc1)C(O)=O)c1ccc2OCOc2c1

InChI Key: InChIKey=FHOLSLVTQPRBKJ-KKUQBAQOSA-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 = 50119661   

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))	BDBM50119661 (5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pen...) Show SMILES CCCCCc1ccc2[C@@H]([C@H]([C@@H](c2n1)c1ccc(OC)cc1)C(O)=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C28H29NO5/c1-3-4-5-6-19-10-13-21-24(18-9-14-22-23(15-18)34-16-33-22)26(28(30)31)25(27(21)29-19)17-7-11-20(32-2)12-8-17/h7-15,24-26H,3-6,16H2,1-2H3,(H,30,31)/t24-,25-,26+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.10	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))	BDBM50119661 (5-Benzo[1,3]dioxol-5-yl-7-(4-methoxy-phenyl)-2-pen...) Show SMILES CCCCCc1ccc2[C@@H]([C@H]([C@@H](c2n1)c1ccc(OC)cc1)C(O)=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C28H29NO5/c1-3-4-5-6-19-10-13-21-24(18-9-14-22-23(15-18)34-16-33-22)26(28(30)31)25(27(21)29-19)17-7-11-20(32-2)12-8-17/h7-15,24-26H,3-6,16H2,1-2H3,(H,30,31)/t24-,25-,26+/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.90	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