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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 = 'BDBM50163895'   
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))
BDBM50163895
PNG
((S)-2-Amino-3-[4-(4-hydroxy-3-iodo-phenoxy)-3-iodo...)
Show SMILES Cc1cc(C[C@H](N)C(O)=O)cc(I)c1Oc1ccc(O)c(I)c1
Show InChI InChI=1S/C16H15I2NO4/c1-8-4-9(6-13(19)16(21)22)5-12(18)15(8)23-10-2-3-14(20)11(17)7-10/h2-5,7,13,20H,6,19H2,1H3,(H,21,22)/t13-/m0/s1
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PC sid
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Patents


Similars

Article
PubMed
n/an/an/an/a 0.200n/an/an/an/a



BAYER HealthCare AG

Curated by ChEMBL


Assay Description
Agonist activity towards thyroid hormone receptor expressed in human HepG2 cells


Bioorg Med Chem Lett 15: 1835-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.028
BindingDB Entry DOI: 10.7270/Q290239F
More data for this
Ligand-Target Pair