Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 547.5 BDBM50400631

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
Protein-glutamine gamma-glutamyltransferase 2 (Homo sapiens (Human))	BDBM50400631 (CHEMBL2203475) Show SMILES FC(F)(F)c1cccnc1N1CCN(CC1)C(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C27H32F3N5O4/c1-2-23(36)31-13-7-6-12-22(33-26(38)39-19-20-9-4-3-5-10-20)25(37)35-17-15-34(16-18-35)24-21(27(28,29)30)11-8-14-32-24/h2-5,8-11,14,22H,1,6-7,12-13,15-19H2,(H,31,36)(H,33,38)/t22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Irreversible inhibition of transglutaminase 2				ACS Med Chem Lett 3: 1024-1028 (2012) Article DOI: 10.1021/ml300241m BindingDB Entry DOI: 10.7270/Q2TB1823
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