Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 11B1, mitochondrial' and Ligand = 'BDBM50456831'   

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 11B1, mitochondrial (Homo sapiens (Human))	BDBM50456831 (CHEMBL4203608) Show SMILES O=c1c2ccc(Cn3ccnc3)cc2oc2cc(OCC3CC3)ccc12 Show InChI InChI=1S/C21H18N2O3/c24-21-17-5-3-15(11-23-8-7-22-13-23)9-19(17)26-20-10-16(4-6-18(20)21)25-12-14-1-2-14/h3-10,13-14H,1-2,11-12H2	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Inhibition of human CYP11B1 expressed in hamster V79MZh cells using [1,2-3H]-11-deoxycorticosterone as substrate after 6 hrs by HPTLC analysis				Eur J Med Chem 139: 60-67 (2017) Article DOI: 10.1016/j.ejmech.2017.07.078 BindingDB Entry DOI: 10.7270/Q2BZ68NG
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