Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 335.3 BDBM50445260

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Perforin-1 (Homo sapiens (Human))	BDBM50445260 (CHEMBL3103654) Show SMILES O=C1NC(=S)N\C1=C/c1cccc(c1)-c1ccc2C(=O)NCc2c1 Show InChI InChI=1S/C18H13N3O2S/c22-16-14-5-4-12(8-13(14)9-19-16)11-3-1-2-10(6-11)7-15-17(23)21-18(24)20-15/h1-8H,9H2,(H,19,22)(H2,20,21,23,24)/b15-7-	NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant perforin (unknown origin)-mediated lysis of human [51Cr]-labelled Jurkat cells assessed as release of [51Cr] preincubated f...				J Med Chem 56: 9542-55 (2014) Article DOI: 10.1021/jm401604x BindingDB Entry DOI: 10.7270/Q26Q1ZQ3
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