Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 11B2, mitochondrial' and Ligand = 'BDBM279783'   

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))	BDBM279783 (US10035804, Example 54) Show SMILES C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(N2CC3(CN(C3)C(=O)c3cnn(C)c3)C2)c1C |r| Show InChI InChI=1S/C25H25ClN6O2/c1-15-21(30-11-25(12-30)13-31(14-25)23(33)17-7-28-29(3)10-17)8-27-9-22(15)32-16(2)20-6-18(26)4-5-19(20)24(32)34/h4-10,16H,11-14H2,1-3H3/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.00800	n/a	n/a	n/a	n/a
Hoffman-La Roche Inc. US Patent					Assay Description Herein we identified the use of the G-402 cell line as a host cell to ectopically express (transiently or stably) enzymes of the CYP11 family. Specif...				US Patent US10035804 (2018) BindingDB Entry DOI: 10.7270/Q2GT5Q6H
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