BDBM50094974 CHEMBL3589380

SMILES: CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C11CCOC1)c1ccc(C#N)c(c1)C(F)(F)F

InChI Key: InChIKey=QKKPJFTYJCXESR-UHFFFAOYSA-N

Data: 1 KI

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 = 50094974   

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))	BDBM50094974 (CHEMBL3589380) Show SMILES CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C11CCOC1)c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C22H16F4N4O3S/c1-28-18(31)15-5-4-14(9-17(15)23)30-20(34)29(19(32)21(30)6-7-33-11-21)13-3-2-12(10-27)16(8-13)22(24,25)26/h2-5,8-9H,6-7,11H2,1H3,(H,28,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alla Chem LLC Curated by ChEMBL					Assay Description Antagonist activity at androgen receptor (unknown origin)				Eur J Med Chem 99: 51-66 (2015) Article DOI: 10.1016/j.ejmech.2015.05.039 BindingDB Entry DOI: 10.7270/Q2NP265W
					More data for this Ligand-Target Pair