Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenylate kinase 2, mitochondrial' and Ligand = 'BDBM50367065'   

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
Adenylate kinase 2, mitochondrial (Homo sapiens (Human))	BDBM50367065 (CHEMBL608643) Show SMILES CC(=O)NCCCCCCNc1nc2c(N)ncnc2n1C1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C18H32N7O14P3/c1-10(26)20-6-4-2-3-5-7-21-18-24-12-15(19)22-9-23-16(12)25(18)17-14(28)13(27)11(37-17)8-36-41(32,33)39-42(34,35)38-40(29,30)31/h9,11,13-14,17,27-28H,2-8H2,1H3,(H,20,26)(H,21,24)(H,32,33)(H,34,35)(H2,19,22,23)(H2,29,30,31)/t11-,13-,14-,17?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	6.70E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to inhibit Escherichia coli adenylate kinase II, activity expressed as Inhibition constant				J Med Chem 25: 382-6 (1982) BindingDB Entry DOI: 10.7270/Q24F1R9V
					More data for this Ligand-Target Pair