Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glutaminase kidney isoform, mitochondrial' and Ligand = 'BDBM50509190'   

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))	BDBM50509190 (CHEMBL4589700) Show SMILES O=C(CCc1cn(Cc2ccc(cc2)C#N)nn1)Nc1nnc(CCCCc2nnc(NC(=O)Cc3ccccc3)s2)s1 Show InChI InChI=1S/C29H28N10O2S2/c30-17-21-10-12-22(13-11-21)18-39-19-23(33-38-39)14-15-24(40)31-28-36-34-26(42-28)8-4-5-9-27-35-37-29(43-27)32-25(41)16-20-6-2-1-3-7-20/h1-3,6-7,10-13,19H,4-5,8-9,14-16,18H2,(H,31,36,40)(H,32,37,41)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human GLS1 expressed in Escherichia coli strain BL21 (DE3)pLysS pre-incubated for 10 mins before glutamine addition and measured after ...				J Med Chem 62: 9642-9657 (2019) Article DOI: 10.1021/acs.jmedchem.9b01035 BindingDB Entry DOI: 10.7270/Q2057K75
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50509190 (CHEMBL4589700) Show SMILES O=C(CCc1cn(Cc2ccc(cc2)C#N)nn1)Nc1nnc(CCCCc2nnc(NC(=O)Cc3ccccc3)s2)s1 Show InChI InChI=1S/C29H28N10O2S2/c30-17-21-10-12-22(13-11-21)18-39-19-23(33-38-39)14-15-24(40)31-28-36-34-26(42-28)8-4-5-9-27-35-37-29(43-27)32-25(41)16-20-6-2-1-3-7-20/h1-3,6-7,10-13,19H,4-5,8-9,14-16,18H2,(H,31,36,40)(H,32,37,41)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of N-[2-[(3',6'-dihydroxy-1-oxo-spiro[isobenzofuran-3,9'-xanthene]-5-yl)carbamothioylamino]ethyl]-N'-[6-[4-[5-[[2-(2-pyridyl)acetyl]amino]...				J Med Chem 62: 9642-9657 (2019) Article DOI: 10.1021/acs.jmedchem.9b01035 BindingDB Entry DOI: 10.7270/Q2057K75
					More data for this Ligand-Target Pair