BDBM50120831 CHEMBL3618482

SMILES: CN(C)c1ccc(Nc2nc(cs2)-c2ccc(O)cc2O)cc1

InChI Key: InChIKey=ODIPDNKSGGZOKP-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 = 50120831   

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
Alpha-amylase (Homo sapiens (Human))	BDBM50120831 (CHEMBL3618482) Show SMILES CN(C)c1ccc(Nc2nc(cs2)-c2ccc(O)cc2O)cc1 Show InChI InChI=1S/C17H17N3O2S/c1-20(2)12-5-3-11(4-6-12)18-17-19-15(10-23-17)14-8-7-13(21)9-16(14)22/h3-10,21-22H,1-2H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Freie Universit£t Berlin Curated by ChEMBL					Assay Description Inhibition of human salivary alpha-amylase using GalG2CNP as substrate by UV-Vis spectrophotometric analysis				Bioorg Med Chem 23: 6725-32 (2015) BindingDB Entry DOI: 10.7270/Q21G0P2X
					More data for this Ligand-Target Pair