BDBM50057199 4-Benzyl-5-hydroxy-3-(7-methoxy-benzo[1,3]dioxol-5-yl)-5-(4-methoxy-3-methyl-phenyl)-5H-furan-2-one::CHEMBL275559

SMILES: COc1cc(cc2OCOc12)C1=C(Cc2ccccc2)C(O)(OC1=O)c1ccc(OC)c(C)c1

InChI Key: InChIKey=PSZTVHNFWZCDLF-UHFFFAOYSA-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 = 50057199   

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))	BDBM50057199 (4-Benzyl-5-hydroxy-3-(7-methoxy-benzo[1,3]dioxol-5...) Show SMILES COc1cc(cc2OCOc12)C1=C(Cc2ccccc2)C(O)(OC1=O)c1ccc(OC)c(C)c1 |c:13| Show InChI InChI=1S/C27H24O7/c1-16-11-19(9-10-21(16)30-2)27(29)20(12-17-7-5-4-6-8-17)24(26(28)34-27)18-13-22(31-3)25-23(14-18)32-15-33-25/h4-11,13-14,29H,12,15H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity against human cloned Endothelin B receptor expressed in CHO-K1 cells				J Med Chem 40: 1063-74 (1997) Article DOI: 10.1021/jm9606507 BindingDB Entry DOI: 10.7270/Q27P8XG5
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50057199 (4-Benzyl-5-hydroxy-3-(7-methoxy-benzo[1,3]dioxol-5...) Show SMILES COc1cc(cc2OCOc12)C1=C(Cc2ccccc2)C(O)(OC1=O)c1ccc(OC)c(C)c1 |c:13| Show InChI InChI=1S/C27H24O7/c1-16-11-19(9-10-21(16)30-2)27(29)20(12-17-7-5-4-6-8-17)24(26(28)34-27)18-13-22(31-3)25-23(14-18)32-15-33-25/h4-11,13-14,29H,12,15H2,1-3H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity against human cloned endothelin A receptor expressed in LTK-cells				J Med Chem 40: 1063-74 (1997) Article DOI: 10.1021/jm9606507 BindingDB Entry DOI: 10.7270/Q27P8XG5
					More data for this Ligand-Target Pair