BDBM50237446 CHEMBL4090608

SMILES: COc1cc(NC(=S)NCCCn2cncc2C)ccc1OCCC1CCNCC1

InChI Key: InChIKey=VVPOIPJZXXIMKU-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 = 50237446   

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
Glutaminyl Cyclase (Homo sapiens (Human))	BDBM50237446 (CHEMBL4090608) Show SMILES COc1cc(NC(=S)NCCCn2cncc2C)ccc1OCCC1CCNCC1 Show InChI InChI=1S/C22H33N5O2S/c1-17-15-24-16-27(17)12-3-9-25-22(30)26-19-4-5-20(21(14-19)28-2)29-13-8-18-6-10-23-11-7-18/h4-5,14-16,18,23H,3,6-13H2,1-2H3,(H2,25,26,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Inhibition of human glutaminyl cyclase assessed as reduction in conversion of H-Gln-AMC hydrobromide to pGlu-AMC preincubated with substrate for 10 m...				J Med Chem 60: 2573-2590 (2017) Article DOI: 10.1021/acs.jmedchem.7b00098 BindingDB Entry DOI: 10.7270/Q23X88X9
					More data for this Ligand-Target Pair