Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glutaminase kidney isoform, mitochondrial' and Ligand = 'BDBM108991'   

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
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM108991 (US8604016, 573 | US9938267, Cmpd ID 573) Show SMILES COC(=O)NCc1cccc(CC(=O)Nc2nnc(CCCCc3ccc(NC(=O)Cc4cccc(CNC(=O)OC)c4)nn3)s2)c1 Show InChI InChI=1S/C32H36N8O6S/c1-45-31(43)33-19-23-9-5-7-21(15-23)17-27(41)35-26-14-13-25(37-38-26)11-3-4-12-29-39-40-30(47-29)36-28(42)18-22-8-6-10-24(16-22)20-34-32(44)46-2/h5-10,13-16H,3-4,11-12,17-20H2,1-2H3,(H,33,43)(H,34,44)(H,35,38,41)(H,36,40,42)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...				J Med Chem 51: 1681-94 (2008) BindingDB Entry DOI: 10.7270/Q2JS9SQV
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM108991 (US8604016, 573 | US9938267, Cmpd ID 573) Show SMILES COC(=O)NCc1cccc(CC(=O)Nc2nnc(CCCCc3ccc(NC(=O)Cc4cccc(CNC(=O)OC)c4)nn3)s2)c1 Show InChI InChI=1S/C32H36N8O6S/c1-45-31(43)33-19-23-9-5-7-21(15-23)17-27(41)35-26-14-13-25(37-38-26)11-3-4-12-29-39-40-30(47-29)36-28(42)18-22-8-6-10-24(16-22)20-34-32(44)46-2/h5-10,13-16H,3-4,11-12,17-20H2,1-2H3,(H,33,43)(H,34,44)(H,35,38,41)(H,36,40,42)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Calithera Biosciences Inc. US Patent					Assay Description Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...				US Patent US8604016 (2013) BindingDB Entry DOI: 10.7270/Q2CC0ZBW
					More data for this Ligand-Target Pair