BDBM19981 (1S,9S,10R)-4-hydroxy-9-(4-hydroxyphenyl)-8-oxatricyclo[8.4.0.0^{2,7}]tetradeca-2(7),3,5-trien-12-one::Cyclohexanone, 3b::racemic mixture

SMILES: Oc1ccc(cc1)[C@H]1Oc2ccc(O)cc2[C@H]2CCC(=O)C[C@@H]12

InChI Key: InChIKey=CYXAWKURWPNXGM-SZVBFZGTSA-N

Data: 2 KI

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 = 19981   

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
Estradiol receptor beta (ERβ) (Homo sapiens (Human))	BDBM19981 ((1S,9S,10R)-4-hydroxy-9-(4-hydroxyphenyl)-8-oxatri...) Show SMILES Oc1ccc(cc1)[C@H]1Oc2ccc(O)cc2[C@H]2CCC(=O)C[C@@H]12 |r| Show InChI InChI=1S/C19H18O4/c20-12-3-1-11(2-4-12)19-17-10-13(21)5-7-15(17)16-9-14(22)6-8-18(16)23-19/h1-4,6,8-9,15,17,19-20,22H,5,7,10H2/t15-,17-,19-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	10.2	-10.8	n/a	n/a	n/a	n/a	n/a	7.5	22
Lilly Research Laboratories					Assay Description The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin...				Bioorg Med Chem Lett 17: 4824-8 (2007) Article DOI: 10.1016/j.bmcl.2007.06.052 BindingDB Entry DOI: 10.7270/Q2CJ8BRK
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM19981 ((1S,9S,10R)-4-hydroxy-9-(4-hydroxyphenyl)-8-oxatri...) Show SMILES Oc1ccc(cc1)[C@H]1Oc2ccc(O)cc2[C@H]2CCC(=O)C[C@@H]12 |r| Show InChI InChI=1S/C19H18O4/c20-12-3-1-11(2-4-12)19-17-10-13(21)5-7-15(17)16-9-14(22)6-8-18(16)23-19/h1-4,6,8-9,15,17,19-20,22H,5,7,10H2/t15-,17-,19-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	410	-8.62	n/a	n/a	n/a	n/a	n/a	7.5	22
Lilly Research Laboratories					Assay Description The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin...				Bioorg Med Chem Lett 17: 4824-8 (2007) Article DOI: 10.1016/j.bmcl.2007.06.052 BindingDB Entry DOI: 10.7270/Q2CJ8BRK
					More data for this Ligand-Target Pair