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SMILES: Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1

InChI Key: InChIKey=NBNSBPOETAKHET-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50123206   

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 (RAT)	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for Rat Estrogen receptor-alpha				Bioorg Med Chem Lett 13: 479-83 (2003) BindingDB Entry DOI: 10.7270/Q2F76BXK
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for Human Estrogen receptor-alpha				Bioorg Med Chem Lett 13: 479-83 (2003) BindingDB Entry DOI: 10.7270/Q2F76BXK
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor beta				Bioorg Med Chem Lett 14: 1317-21 (2004) Article DOI: 10.1016/j.bmcl.2003.12.058 BindingDB Entry DOI: 10.7270/Q2Z60NGH
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for Human Estrogen receptor-beta				Bioorg Med Chem Lett 13: 479-83 (2003) BindingDB Entry DOI: 10.7270/Q2F76BXK
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for estrogen receptor alpha				Bioorg Med Chem Lett 14: 1317-21 (2004) Article DOI: 10.1016/j.bmcl.2003.12.058 BindingDB Entry DOI: 10.7270/Q2Z60NGH
					More data for this Ligand-Target Pair
Estrogen receptor beta (Rattus norvegicus)	BDBM50123206 (2-(3-hydroxyphenyl)-1,2'-spirobi[1H-indene]-5-ol |...) Show SMILES Oc1ccc2c(C=C(c3cccc(O)c3)C22Cc3ccccc3C2)c1 |t:6| Show InChI InChI=1S/C23H18O2/c24-19-7-3-6-15(10-19)22-12-18-11-20(25)8-9-21(18)23(22)13-16-4-1-2-5-17(16)14-23/h1-12,24-25H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity foor Rat Estrogen receptor-beta				Bioorg Med Chem Lett 13: 479-83 (2003) BindingDB Entry DOI: 10.7270/Q2F76BXK
					More data for this Ligand-Target Pair