BDBM50250906 4',5,7-trihydroxy-6,8-dimethylisoflavone::CHEMBL512579

SMILES: Cc1c(O)c(C)c2occ(-c3ccc(O)cc3)c(=O)c2c1O

InChI Key: InChIKey=VSEIMGCATUFLSE-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 = 50250906   

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
Estrogen receptor (Homo sapiens (Human))	BDBM50250906 (4',5,7-trihydroxy-6,8-dimethylisoflavone | CHEMBL5...) Show SMILES Cc1c(O)c(C)c2occ(-c3ccc(O)cc3)c(=O)c2c1O Show InChI InChI=1S/C17H14O5/c1-8-14(19)9(2)17-13(15(8)20)16(21)12(7-22-17)10-3-5-11(18)6-4-10/h3-7,18-20H,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université de Lausanne Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from human recombinant ERalpha				J Nat Prod 65: 1749-53 (2002) Article DOI: 10.1021/np0201164 BindingDB Entry DOI: 10.7270/Q2S46RQX
					More data for this Ligand-Target Pair
Estradiol receptor beta (ERβ) (Homo sapiens (Human))	BDBM50250906 (4',5,7-trihydroxy-6,8-dimethylisoflavone | CHEMBL5...) Show SMILES Cc1c(O)c(C)c2occ(-c3ccc(O)cc3)c(=O)c2c1O Show InChI InChI=1S/C17H14O5/c1-8-14(19)9(2)17-13(15(8)20)16(21)12(7-22-17)10-3-5-11(18)6-4-10/h3-7,18-20H,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
Université de Lausanne Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from human recombinant ERbeta				J Nat Prod 65: 1749-53 (2002) Article DOI: 10.1021/np0201164 BindingDB Entry DOI: 10.7270/Q2S46RQX
					More data for this Ligand-Target Pair