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SMILES: COc1cccc2OC(C)c3c(ccc4[nH]c(=O)cc(C)c34)-c12

InChI Key: InChIKey=LWPGBKLIVJGZBQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50373243   

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
Androgen receptor (Homo sapiens (Human))	BDBM50373243 (CHEMBL253744) Show SMILES COc1cccc2OC(C)c3c(ccc4[nH]c(=O)cc(C)c34)-c12 |w:8.8| Show InChI InChI=1S/C19H17NO3/c1-10-9-16(21)20-13-8-7-12-18(17(10)13)11(2)23-15-6-4-5-14(22-3)19(12)15/h4-9,11H,1-3H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity to human androgen receptor expressed in monkey COS7 cells by whole cell binding assay				Bioorg Med Chem Lett 18: 3431-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.085 BindingDB Entry DOI: 10.7270/Q25M66J9
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50373243 (CHEMBL253744) Show SMILES COc1cccc2OC(C)c3c(ccc4[nH]c(=O)cc(C)c34)-c12 |w:8.8| Show InChI InChI=1S/C19H17NO3/c1-10-9-16(21)20-13-8-7-12-18(17(10)13)11(2)23-15-6-4-5-14(22-3)19(12)15/h4-9,11H,1-3H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human androgen receptor african green monkey CV1 cells by cotransfection assay				Bioorg Med Chem Lett 18: 3431-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.085 BindingDB Entry DOI: 10.7270/Q25M66J9
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50373243 (CHEMBL253744) Show SMILES COc1cccc2OC(C)c3c(ccc4[nH]c(=O)cc(C)c34)-c12 |w:8.8| Show InChI InChI=1S/C19H17NO3/c1-10-9-16(21)20-13-8-7-12-18(17(10)13)11(2)23-15-6-4-5-14(22-3)19(12)15/h4-9,11H,1-3H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Antagonist activity at human androgen receptor african green monkey CV1 cells by cotransfection assay				Bioorg Med Chem Lett 18: 3431-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.085 BindingDB Entry DOI: 10.7270/Q25M66J9
					More data for this Ligand-Target Pair