BDBM50353561 CHEMBL1830785

SMILES: CC1(C)CN(CCCO)C(=O)C1Oc1ccc(C#N)c(c1)C(F)(F)F

InChI Key: InChIKey=XAYJHRIULPDUAF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50353561   

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))	BDBM50353561 (CHEMBL1830785) Show SMILES CC1(C)CN(CCCO)C(=O)C1Oc1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C17H19F3N2O3/c1-16(2)10-22(6-3-7-23)15(24)14(16)25-12-5-4-11(9-21)13(8-12)17(18,19)20/h4-5,8,14,23H,3,6-7,10H2,1-2H3	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	523	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human androgen receptor				Bioorg Med Chem Lett 21: 5230-3 (2011) Article DOI: 10.1016/j.bmcl.2011.07.048 BindingDB Entry DOI: 10.7270/Q21836WZ
					More data for this Ligand-Target Pair