BDBM50220307 CHEMBL237061::N-(diaminomethylene)-2-(2-phenyl-4-(4-propoxyphenyl)thiophen-3-yl)acetamide

SMILES: CCCOc1ccc(cc1)-c1csc(c1CC(=O)NC(N)=N)-c1ccccc1

InChI Key: InChIKey=VEPRQHCGLVQXNQ-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 = 50220307   

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))	BDBM50220307 (CHEMBL237061 | N-(diaminomethylene)-2-(2-phenyl-4-...) Show SMILES CCCOc1ccc(cc1)-c1csc(c1CC(=O)NC(N)=N)-c1ccccc1 Show InChI InChI=1S/C22H23N3O2S/c1-2-12-27-17-10-8-15(9-11-17)19-14-28-21(16-6-4-3-5-7-16)18(19)13-20(26)25-22(23)24/h3-11,14H,2,12-13H2,1H3,(H4,23,24,25,26)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of BACE1 by FRET assay				Bioorg Med Chem Lett 17: 5353-6 (2007) Article DOI: 10.1016/j.bmcl.2007.08.010 BindingDB Entry DOI: 10.7270/Q2WQ03GF
					More data for this Ligand-Target Pair