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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM99309'   
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
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM99309
PNG
(US8497281, 87)
Show SMILES Fc1cc(F)c2CC[C@H]3C(CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1 |r|
Show InChI InChI=1S/C21H19F2N3O/c22-13-9-16-14(17(23)10-13)4-6-20-15(16)2-1-7-26(20)21(27)12-3-5-18-19(8-12)25-11-24-18/h3,5,8-11,15,20H,1-2,4,6-7H2,(H,24,25)/t15?,20-/m0/s1
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MMDB

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Similars

US Patent
n/an/a 227n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair