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BDBM99459 US8497281, 237

SMILES: Cc1nc2cc3C[C@H]4[C@H](CCCN4C(=O)c4ccc5nc[nH]c5c4)c3cc2o1

InChI Key: InChIKey=FGANXIQPUHEMEK-QRWLVFNGSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 99459   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM99459
PNG
(US8497281, 237)
Show SMILES Cc1nc2cc3C[C@H]4[C@H](CCCN4C(=O)c4ccc5nc[nH]c5c4)c3cc2o1 |r|
Show InChI InChI=1S/C22H20N4O2/c1-12-25-19-8-14-9-20-15(16(14)10-21(19)28-12)3-2-6-26(20)22(27)13-4-5-17-18(7-13)24-11-23-17/h4-5,7-8,10-11,15,20H,2-3,6,9H2,1H3,(H,23,24)/t15-,20+/m1/s1
PDB
MMDB

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Similars

US Patent
n/an/a 248n/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