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BDBM119216 US8673938, 74

SMILES: CCSc1nc(ccc1C(=O)NC1C2CC3CC(C2)CC1C3)N1CC[C@H](C1)C(O)=O

InChI Key: InChIKey=KXRYVJZOORPUHV-BWVQPMQLSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 119216   
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))		BDBM119216
PNG
(US8673938, 74)
Show SMILES CCSc1nc(ccc1C(=O)NC1C2CC3CC(C2)CC1C3)N1CC[C@H](C1)C(O)=O |r,wU:25.31,TLB:11:12:19:15.16.21,14:15:19:12.13.18,THB:11:12:15.14.21:19.17.18,14:13:19:15.16.21,16:15:12:19.17.18,16:17:12:15.14.21,(1.34,3.16,;2.43,2.07,;2.03,.58,;.54,.18,;-.55,1.27,;-2.03,.87,;-2.43,-.62,;-1.34,-1.71,;.15,-1.31,;1.23,-2.4,;.84,-3.88,;2.72,-2,;3.81,-3.09,;5.14,-2.32,;6.47,-3.09,;6.47,-4.63,;5.58,-6.55,;4.37,-5.88,;4.39,-3.48,;2.98,-6.53,;3.81,-4.63,;5.14,-5.4,;-3.12,1.96,;-4.59,1.48,;-5.49,2.73,;-4.59,3.98,;-3.12,3.5,;-4.98,5.46,;-3.9,6.55,;-6.47,5.86,)|
Show InChI InChI=1S/C23H31N3O3S/c1-2-30-22-18(3-4-19(24-22)26-6-5-15(12-26)23(28)29)21(27)25-20-16-8-13-7-14(10-16)11-17(20)9-13/h3-4,13-17,20H,2,5-12H2,1H3,(H,25,27)(H,28,29)/t13?,14?,15-,16?,17?,20?/m1/s1
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Similars
US Patent
n/an/a 6n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
The conversion of cortisone to the active steroid cortisol by 11βHSD1 oxo-reductase activity, can be measured using a competitive homogeneous ti...

US Patent US8673938 (2014)


BindingDB Entry DOI: 10.7270/Q2610Z0D
More data for this
Ligand-Target Pair