null

SMILES: COc1c(O)ccc2OCc3c(ccc4[nH]c(=O)cc(C)c34)-c12

InChI Key: InChIKey=QCVFCDABUAOLFG-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50373231   

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))	BDBM50373231 (CHEMBL427731) Show SMILES COc1c(O)ccc2OCc3c(ccc4[nH]c(=O)cc(C)c34)-c12 Show InChI InChI=1S/C18H15NO4/c1-9-7-15(21)19-12-4-3-10-11(16(9)12)8-23-14-6-5-13(20)18(22-2)17(10)14/h3-7,20H,8H2,1-2H3,(H,19,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	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))	BDBM50373231 (CHEMBL427731) Show SMILES COc1c(O)ccc2OCc3c(ccc4[nH]c(=O)cc(C)c34)-c12 Show InChI InChI=1S/C18H15NO4/c1-9-7-15(21)19-12-4-3-10-11(16(9)12)8-23-14-6-5-13(20)18(22-2)17(10)14/h3-7,20H,8H2,1-2H3,(H,19,21)	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	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Activity at androgen receptor in human Saos2 cells assessed as IL6 repression				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))	BDBM50373231 (CHEMBL427731) Show SMILES COc1c(O)ccc2OCc3c(ccc4[nH]c(=O)cc(C)c34)-c12 Show InChI InChI=1S/C18H15NO4/c1-9-7-15(21)19-12-4-3-10-11(16(9)12)8-23-14-6-5-13(20)18(22-2)17(10)14/h3-7,20H,8H2,1-2H3,(H,19,21)	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	306	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))	BDBM50373231 (CHEMBL427731) Show SMILES COc1c(O)ccc2OCc3c(ccc4[nH]c(=O)cc(C)c34)-c12 Show InChI InChI=1S/C18H15NO4/c1-9-7-15(21)19-12-4-3-10-11(16(9)12)8-23-14-6-5-13(20)18(22-2)17(10)14/h3-7,20H,8H2,1-2H3,(H,19,21)	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	19	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