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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen-related receptor gamma' and Ligand = 'BDBM50455413'   
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
Estrogen-related receptor gamma


(Homo sapiens (Human))
BDBM50455413
PNG
(CHEMBL4208949)
Show SMILES CCC(C)N(CC)c1ccc(CCNC(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C21H28N2O2/c1-4-16(3)23(5-2)19-10-6-17(7-11-19)14-15-22-21(25)18-8-12-20(24)13-9-18/h6-13,16,24H,4-5,14-15H2,1-3H3,(H,22,25)
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 3.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human N-terminal alphaHis-SUMO-tagged ERRgamma-LBD (229 to 458 residues) expressed in Escherichia coli BL21 gold (DE3) cells asse...


Bioorg Med Chem Lett 28: 1313-1319 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.019
BindingDB Entry DOI: 10.7270/Q2RF5XKM
More data for this
Ligand-Target Pair