Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 479.5 BDBM50400634

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))	BDBM50400634 (CHEMBL2203472) Show SMILES C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(CC1)c1ccccn1 |r| Show InChI InChI=1S/C26H33N5O4/c1-2-24(32)28-15-8-6-12-22(29-26(34)35-20-21-10-4-3-5-11-21)25(33)31-18-16-30(17-19-31)23-13-7-9-14-27-23/h2-5,7,9-11,13-14,22H,1,6,8,12,15-20H2,(H,28,32)(H,29,34)/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	260	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
					More data for this Ligand-Target Pair