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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glucocorticoid receptor' and Ligand = 'BDBM50269239'   
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
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50269239
PNG
(CHEMBL501713 | sundaicumone A)
Show SMILES CCCC(CC(O)=O)C1=C2O[C@@H](C[C@@]22C[C@H](CC(O)C(C)(C)O)C(C)(C)[C@@](C(=O)C(C)CC)(C1=O)C2=O)C(C)(C)O |r,c:8,THB:36:35:33.8.9:14.23.15|
Show InChI InChI=1S/C32H50O9/c1-10-12-18(13-22(34)35)23-25(37)32(24(36)17(3)11-2)27(38)31(16-21(30(8,9)40)41-26(23)31)15-19(28(32,4)5)14-20(33)29(6,7)39/h17-21,33,39-40H,10-16H2,1-9H3,(H,34,35)/t17?,18?,19-,20?,21-,31-,32-/m0/s1
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KEGG

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Similars
Article
PubMed
n/an/an/an/a 1.73E+5n/an/an/an/a



MerLion Pharmaceuticals

Curated by ChEMBL


Assay Description
Activity at glucocorticoid receptor in human A549 cells assessed as effect on GRE promoter response by luciferase reporter assay

J Nat Prod 69: 707-9 (2006)


Article DOI: 10.1021/np050528n
BindingDB Entry DOI: 10.7270/Q2QJ7J6M
More data for this
Ligand-Target Pair