BDBM50057203 3-Benzo[1,3]dioxol-5-yl-5-hydroxy-5-(4-methoxy-phenyl)-4-(3-trifluoromethyl-benzyl)-5H-furan-2-one::CHEMBL10676

SMILES: COc1ccc(cc1)C1(O)OC(=O)C(=C1Cc1cccc(c1)C(F)(F)F)c1ccc2OCOc2c1

InChI Key: InChIKey=YLUYDFCTBUPYGJ-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 = 50057203   

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
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50057203 (3-Benzo[1,3]dioxol-5-yl-5-hydroxy-5-(4-methoxy-phe...) Show SMILES COc1ccc(cc1)C1(O)OC(=O)C(=C1Cc1cccc(c1)C(F)(F)F)c1ccc2OCOc2c1 |c:14| Show InChI InChI=1S/C26H19F3O6/c1-32-19-8-6-17(7-9-19)25(31)20(12-15-3-2-4-18(11-15)26(27,28)29)23(24(30)35-25)16-5-10-21-22(13-16)34-14-33-21/h2-11,13,31H,12,14H2,1H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	43	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
EDNRB (Homo sapiens (Human))	BDBM50057203 (3-Benzo[1,3]dioxol-5-yl-5-hydroxy-5-(4-methoxy-phe...) Show SMILES COc1ccc(cc1)C1(O)OC(=O)C(=C1Cc1cccc(c1)C(F)(F)F)c1ccc2OCOc2c1 |c:14| Show InChI InChI=1S/C26H19F3O6/c1-32-19-8-6-17(7-9-19)25(31)20(12-15-3-2-4-18(11-15)26(27,28)29)23(24(30)35-25)16-5-10-21-22(13-16)34-14-33-21/h2-11,13,31H,12,14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.50E+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