BDBM50051057 CHEMBL3318056

SMILES: O=C(N(CCC#N)Cc1ccccc1)c1cc2ccccc2[nH]1

InChI Key: InChIKey=HZEQDLVVOBQKQR-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50051057   

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))	BDBM50051057 (CHEMBL3318056) Show SMILES O=C(N(CCC#N)Cc1ccccc1)c1cc2ccccc2[nH]1 Show InChI InChI=1S/C19H17N3O/c20-11-6-12-22(14-15-7-2-1-3-8-15)19(23)18-13-16-9-4-5-10-17(16)21-18/h1-5,7-10,13,21H,6,12,14H2	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	7.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of androgen receptor binding function 3 in eGFP-expressing human LNCAP cells containing androgen-responsive probasin-derived promoter asse...				J Med Chem 57: 6867-72 (2014) Article DOI: 10.1021/jm500684r BindingDB Entry DOI: 10.7270/Q29S1SNR
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM50051057 (CHEMBL3318056) Show SMILES O=C(N(CCC#N)Cc1ccccc1)c1cc2ccccc2[nH]1 Show InChI InChI=1S/C19H17N3O/c20-11-6-12-22(14-15-7-2-1-3-8-15)19(23)18-13-16-9-4-5-10-17(16)21-18/h1-5,7-10,13,21H,6,12,14H2	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	4.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of androgen receptor binding function 3 in human LNCAP cells containing androgen-responsive probasin-derived promoter assessed as reductio...				J Med Chem 57: 6867-72 (2014) Article DOI: 10.1021/jm500684r BindingDB Entry DOI: 10.7270/Q29S1SNR
					More data for this Ligand-Target Pair