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SMILES: C[C@H]1CCN([C@H]2Cc3ccccc3[C@@H]12)C(=O)c1ccc2nc[nH]c2c1

InChI Key: InChIKey=BRUKCJCBSLIOTE-QTJFZDIUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 99435   
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))		BDBM99435
PNG
(US8497281, 213)
Show SMILES C[C@H]1CCN([C@H]2Cc3ccccc3[C@@H]12)C(=O)c1ccc2nc[nH]c2c1 |r|
Show InChI InChI=1S/C21H21N3O/c1-13-8-9-24(19-11-14-4-2-3-5-16(14)20(13)19)21(25)15-6-7-17-18(10-15)23-12-22-17/h2-7,10,12-13,19-20H,8-9,11H2,1H3,(H,22,23)/t13-,19-,20+/m0/s1
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Similars
US Patent
n/an/a 55n/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