Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein-glutamine gamma-glutamyltransferase 2' and Ligand = 'BDBM50392914'   

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))	BDBM50392914 (CHEMBL2152212) Show SMILES C=CC(=O)NC1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)NCCc1cccc2CCOc12 Show InChI InChI=1S/C25H29N3O5S/c1-2-23(29)27-21-11-15-28(16-12-21)34(31,32)22-8-6-20(7-9-22)25(30)26-14-10-18-4-3-5-19-13-17-33-24(18)19/h2-9,21H,1,10-17H2,(H,26,30)(H,27,29)	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 Inhibition of human TGM2				ACS Med Chem Lett 3: 731-735 (2012) Article DOI: 10.1021/ml3001352 BindingDB Entry DOI: 10.7270/Q2Q241B7
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