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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 11B2 (CYP11B2)' and Ligand = 'BDBM279745'   
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 (CYP11B2)


(Homo sapiens (Human))
BDBM279745
PNG
(US10035804, Example 16)
Show SMILES COc1ccc2C(=O)N(c3cncc(c3)N3CC4(CN(C4)C(=O)c4cnccc4C)C3)C(C)(C)c2n1
Show InChI InChI=1S/C27H28N6O3/c1-17-7-8-28-12-21(17)24(34)32-15-27(16-32)13-31(14-27)18-9-19(11-29-10-18)33-25(35)20-5-6-22(36-4)30-23(20)26(33,2)3/h5-12H,13-16H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 0.0830n/an/an/an/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)

More data for this
Ligand-Target Pair