Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein-glutamine gamma-glutamyltransferase 2' and Ligand = 'BDBM50342595'   

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))	BDBM50342595 ((E)-ethyl 2-(4-chloro-2-oxo-3-(2-oxo-2-(pyridin-3-...) Show SMILES CCOC(=O)N1C(=O)\C(=C\C(=O)c2cccnc2)c2c1cccc2Cl Show InChI InChI=1S/C18H13ClN2O4/c1-2-25-18(24)21-14-7-3-6-13(19)16(14)12(17(21)23)9-15(22)11-5-4-8-20-10-11/h3-10H,2H2,1H3/b12-9+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Stanford University Curated by ChEMBL					Assay Description Inhibition of human transglutaminase 2 using Cbz-Gln-Gly as a substrate by GDH-coupled assay				Bioorg Med Chem Lett 21: 2692-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.037 BindingDB Entry DOI: 10.7270/Q2CN7471
					More data for this Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase 2 (Homo sapiens (Human))	BDBM50342595 ((E)-ethyl 2-(4-chloro-2-oxo-3-(2-oxo-2-(pyridin-3-...) Show SMILES CCOC(=O)N1C(=O)\C(=C\C(=O)c2cccnc2)c2c1cccc2Cl Show InChI InChI=1S/C18H13ClN2O4/c1-2-25-18(24)21-14-7-3-6-13(19)16(14)12(17(21)23)9-15(22)11-5-4-8-20-10-11/h3-10H,2H2,1H3/b12-9+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Stanford University Curated by ChEMBL					Assay Description Inhibition of human transglutaminase 2 using ZGBC as a substrate after 30 to 60 mins by fluorometric assay				Bioorg Med Chem Lett 21: 2692-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.037 BindingDB Entry DOI: 10.7270/Q2CN7471
					More data for this Ligand-Target Pair