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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase type 2' and Ligand = 'BDBM50145442'   
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 type 2


(Homo sapiens (Human))		BDBM50145442
PNG
(CHEMBL3765140)
Show SMILES CC(C)C1=CC[C@H](C(=O)NC(C)C23CC4CC(CC(C4)C2)C3)[C@]11CCC(=O)C=C1 |r,c:31,t:3,TLB:19:14:21:18.17.20,19:18:21:15.14.13,THB:13:14:17:21.12.20,13:12:15.14.19:17,10:12:15.14.19:17|
Show InChI InChI=1S/C26H37NO2/c1-16(2)22-4-5-23(26(22)8-6-21(28)7-9-26)24(29)27-17(3)25-13-18-10-19(14-25)12-20(11-18)15-25/h4,6,8,16-20,23H,5,7,9-15H2,1-3H3,(H,27,29)/t17?,18?,19?,20?,23-,25?,26-/m1/s1
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Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of full length human 11beta-HSD2 expressed in HEK293 cells using cortisone as substrate incubated for 2 hrs by HTRF assay in presence of N...

Eur J Med Chem 110: 126-32 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.027
BindingDB Entry DOI: 10.7270/Q28P62DG
More data for this
Ligand-Target Pair