Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Isocitrate dehydrogenase [NADP] cytoplasmic' and Ligand = 'BDBM50586264'   

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
Isocitrate dehydrogenase [NADP] cytoplasmic (Homo sapiens (Human))	BDBM50586264 (CHEMBL5074633) Show SMILES CC(C)O[C@H]1CC[C@@H](CC1)C(=O)N1Cc2cc(cnc2Nc2ccc(cc12)N1CC2CCC1CO2)S(C)(=O)=O |r,wU:7.10,wD:4.3,(6.76,5.45,;5.67,4.36,;6.07,2.87,;4.18,4.76,;3.09,3.67,;1.6,4.07,;.51,2.98,;.91,1.49,;2.4,1.09,;3.49,2.18,;-.18,.4,;-1.66,.8,;.22,-1.09,;1.72,-1.43,;2.4,-2.81,;3.91,-2.7,;4.76,-3.97,;4.1,-5.34,;2.58,-5.45,;1.72,-4.18,;.23,-4.53,;-.98,-3.58,;-2.3,-4.34,;-3.64,-3.58,;-3.64,-2.04,;-2.31,-1.27,;-.98,-2.04,;-4.97,-1.27,;-6.31,-2.04,;-7.64,-1.27,;-6.87,.07,;-5.98,-1.06,;-4.97,.27,;-6.31,1.04,;-7.64,.27,;6.3,-3.97,;7.07,-5.31,;7.64,-3.2,;6.3,-2.43,)| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of IDH1 R132H mutant (unknown origin) assessed as reduction in NADPH consumption using alpha-KG as substrate incubated for 60 mins by Kina...				Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00089 BindingDB Entry DOI: 10.7270/Q2RJ4PCP
					More data for this Ligand-Target Pair