BDBM50398908 CHEMBL2178752

SMILES: Cc1onc(c1C(=O)NC(N)=NCc1ccc(Cl)c(Cl)c1)-c1ccccc1

InChI Key: InChIKey=QUCYDIZKOIETCN-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 = 50398908   

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
Beta-secretase 1 (Homo sapiens (Human))	BDBM50398908 (CHEMBL2178752) Show SMILES Cc1onc(c1C(=O)NC(N)=NCc1ccc(Cl)c(Cl)c1)-c1ccccc1 |w:11.12| Show InChI InChI=1S/C19H16Cl2N4O2/c1-11-16(17(25-27-11)13-5-3-2-4-6-13)18(26)24-19(22)23-10-12-7-8-14(20)15(21)9-12/h2-9H,10H2,1H3,(H3,22,23,24,26)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research Curated by ChEMBL					Assay Description Displacement of [3H]BMS-599240 from BACE1 expressed in HEK293 cells				J Med Chem 55: 9208-23 (2012) Article DOI: 10.1021/jm300931y BindingDB Entry DOI: 10.7270/Q20G3M8M
					More data for this Ligand-Target Pair