BDBM50459868 CHEMBL4225339

SMILES: CC(O)(CS(=O)(=O)c1ccc(cc1)C(O)=O)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F

InChI Key: InChIKey=VYZMJELDCKNIEV-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 = 50459868   

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))	BDBM50459868 (CHEMBL4225339) Show SMILES CC(O)(CS(=O)(=O)c1ccc(cc1)C(O)=O)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C19H15F3N2O6S/c1-18(28,10-31(29,30)14-6-3-11(4-7-14)16(25)26)17(27)24-13-5-2-12(9-23)15(8-13)19(20,21)22/h2-8,28H,10H2,1H3,(H,24,27)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Health Sciences Curated by ChEMBL					Assay Description Binding affinity to androgen receptor (unknown origin)				J Med Chem 61: 543-575 (2018) Article DOI: 10.1021/acs.jmedchem.7b00168 BindingDB Entry DOI: 10.7270/Q2VT1VR7
					More data for this Ligand-Target Pair