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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor subfamily 5 group A member 2' and Ligand = 'BDBM50505371'   
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
Nuclear receptor subfamily 5 group A member 2


(Homo sapiens (Human))
BDBM50505371
PNG
(CHEMBL4455426)
Show SMILES [H][C@@]12CC(CCCCCC)=C(c3ccccc3)[C@@]1(CC[C@H]2OS(N)(=O)=O)C(=C)c1ccccc1 |r,t:9|
Show InChI InChI=1S/C28H35NO3S/c1-3-4-5-8-17-24-20-25-26(32-33(29,30)31)18-19-28(25,21(2)22-13-9-6-10-14-22)27(24)23-15-11-7-12-16-23/h6-7,9-16,25-26H,2-5,8,17-20H2,1H3,(H2,29,30,31)/t25-,26+,28-/m0/s1
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Article
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n/an/an/an/a 800n/an/an/an/a



Emory University School of Medicine

Curated by ChEMBL


Assay Description
Agonist activity at human full length LRH1 transfected in human HeLa cells incubated for 24 hrs by renilla luciferase reporter gene assay


J Med Chem 62: 11022-11034 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00753
BindingDB Entry DOI: 10.7270/Q2XK8JT8
More data for this
Ligand-Target Pair