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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thyroid hormone receptor alpha/beta' and Ligand = 'BDBM50477500'   
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
Thyroid hormone receptor alpha/beta


(Homo sapiens (Human))
BDBM50477500
PNG
(CHEMBL248314)
Show SMILES CC(C)c1cc(Oc2c(C)cc3oc(cc3c2C)C(O)=O)ccc1O
Show InChI InChI=1S/C20H20O5/c1-10(2)14-8-13(5-6-16(14)21)24-19-11(3)7-17-15(12(19)4)9-18(25-17)20(22)23/h5-10,21H,1-4H3,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 110n/an/an/an/a



Bayer HealthCare AG

Curated by ChEMBL


Assay Description
Agonist activity at THR in HepG2 cells by whole cell assay


Bioorg Med Chem Lett 17: 3992-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.085
BindingDB Entry DOI: 10.7270/Q2251N06
More data for this
Ligand-Target Pair