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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 11B2, mitochondrial' and Ligand = 'BDBM50092156'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cytochrome P450 11B2, mitochondrial


(Homo sapiens (Human))
BDBM50092156
PNG
(CHEMBL3582452)
Show SMILES CC1(CC1)n1c(nc2ccc(F)cc12)-c1cccnc1
Show InChI InChI=1S/C34H41N3O4/c1-34(19-26-20-35-30-10-6-5-9-28(26)30,33(41)36-27(17-32(39)40)16-21-7-3-2-4-8-21)37-31(38)18-29-24-12-22-11-23(14-24)15-25(29)13-22/h2-10,20,22-25,27,29,35H,11-19H2,1H3,(H,36,41)(H,37,38)(H,39,40)/t22?,23?,24?,25?,27-,29?,34+/m0/s1
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Similars

Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human CYP11B2 expressed in V79 cells incubated for 1 hr before 11-deoxycorticosterone substrate addition by HTRF-based assay


ACS Med Chem Lett 6: 573-8 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00054
BindingDB Entry DOI: 10.7270/Q2K64KT8
More data for this
Ligand-Target Pair