BDBM25430 4-(2-hydroxyphenyl)-2-(trifluoromethyl)benzonitrile::CHEMBL391548::diarylphenol, 5a

SMILES: Oc1ccccc1-c1ccc(C#N)c(c1)C(F)(F)F

InChI Key: InChIKey=CSOANLOTNWGJSK-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 25430   

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))	BDBM25430 (4-(2-hydroxyphenyl)-2-(trifluoromethyl)benzonitril...) Show SMILES Oc1ccccc1-c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C14H8F3NO/c15-14(16,17)12-7-9(5-6-10(12)8-18)11-3-1-2-4-13(11)19/h1-7,19H	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	39.9	n/a	n/a	n/a	n/a	7.4	4
Pfizer					Assay Description The competitive radio-ligand binding analysis was performed on human AR extracts from transfected Sf9 cells in the presence or absence of differing c...				J Med Chem 51: 7010-4 (2008) Article DOI: 10.1021/jm8009316 BindingDB Entry DOI: 10.7270/Q2Z31WZ1
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM25430 (4-(2-hydroxyphenyl)-2-(trifluoromethyl)benzonitril...) Show SMILES Oc1ccccc1-c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C14H8F3NO/c15-14(16,17)12-7-9(5-6-10(12)8-18)11-3-1-2-4-13(11)19/h1-7,19H	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	0.0200	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human AR in MDA-MB453-MMTV-luci cells by functional assay				Bioorg Med Chem Lett 17: 5529-32 (2007) Article DOI: 10.1016/j.bmcl.2007.08.034 BindingDB Entry DOI: 10.7270/Q2CR5T3S
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM25430 (4-(2-hydroxyphenyl)-2-(trifluoromethyl)benzonitril...) Show SMILES Oc1ccccc1-c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C14H8F3NO/c15-14(16,17)12-7-9(5-6-10(12)8-18)11-3-1-2-4-13(11)19/h1-7,19H	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	39.9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]-DHT from human recombinant AR expressed in Sf9 cells				Bioorg Med Chem Lett 17: 5529-32 (2007) Article DOI: 10.1016/j.bmcl.2007.08.034 BindingDB Entry DOI: 10.7270/Q2CR5T3S
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM25430 (4-(2-hydroxyphenyl)-2-(trifluoromethyl)benzonitril...) Show SMILES Oc1ccccc1-c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C14H8F3NO/c15-14(16,17)12-7-9(5-6-10(12)8-18)11-3-1-2-4-13(11)19/h1-7,19H	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Binding affinity at human PR				Bioorg Med Chem Lett 17: 5529-32 (2007) Article DOI: 10.1016/j.bmcl.2007.08.034 BindingDB Entry DOI: 10.7270/Q2CR5T3S
					More data for this Ligand-Target Pair