BDBM50057208 3-Benzo[1,3]dioxol-5-yl-5-(4-methoxy-phenyl)-4-(3,4,5-trimethoxy-benzyl)-5H-furan-2-one::CHEMBL10644

SMILES: COc1ccc(cc1)C1OC(=O)C(=C1Cc1cc(OC)c(OC)c(OC)c1)c1ccc2OCOc2c1

InChI Key: InChIKey=ZNRFEQPTBFAHSC-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 = 50057208   

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))	BDBM50057208 (3-Benzo[1,3]dioxol-5-yl-5-(4-methoxy-phenyl)-4-(3,...) Show SMILES COc1ccc(cc1)C1OC(=O)C(=C1Cc1cc(OC)c(OC)c(OC)c1)c1ccc2OCOc2c1 |c:13| Show InChI InChI=1S/C28H26O8/c1-30-19-8-5-17(6-9-19)26-20(11-16-12-23(31-2)27(33-4)24(13-16)32-3)25(28(29)36-26)18-7-10-21-22(14-18)35-15-34-21/h5-10,12-14,26H,11,15H2,1-4H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	30	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))	BDBM50057208 (3-Benzo[1,3]dioxol-5-yl-5-(4-methoxy-phenyl)-4-(3,...) Show SMILES COc1ccc(cc1)C1OC(=O)C(=C1Cc1cc(OC)c(OC)c(OC)c1)c1ccc2OCOc2c1 |c:13| Show InChI InChI=1S/C28H26O8/c1-30-19-8-5-17(6-9-19)26-20(11-16-12-23(31-2)27(33-4)24(13-16)32-3)25(28(29)36-26)18-7-10-21-22(14-18)35-15-34-21/h5-10,12-14,26H,11,15H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.50E+4	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