Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 11B2, mitochondrial' and Ligand = 'BDBM50238122'   

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
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM50238122 (CHEMBL4083387) Show SMILES CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Cc1ccccc1 Show InChI InChI=1S/C18H23N3O3S/c1-25(23,24)21-9-7-15(8-10-21)18(22)16-12-19-13-20-17(16)11-14-5-3-2-4-6-14/h2-6,12-13,15,18,22H,7-11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi-Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against rat adenylate kinase II was determined in the presence of ATP, non competitive inhibition				Bioorg Med Chem Lett 27: 1902-1906 (2017) Article DOI: 10.1016/j.bmcl.2017.03.034 BindingDB Entry DOI: 10.7270/Q2KS6TTS
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