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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 = 'BDBM50163903'   
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))		BDBM50163903
PNG
(CHEMBL180819 | N-{4-[3-(4-Fluoro-phenoxy)-1H-indol...)
Show SMILES CCOC(=O)C(=O)Nc1cc(c(Oc2ccc3[nH]cc(Oc4ccc(F)cc4)c3c2)c(c1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H17F7N2O5/c1-2-38-24(37)23(36)35-14-9-18(25(28,29)30)22(19(10-14)26(31,32)33)40-16-7-8-20-17(11-16)21(12-34-20)39-15-5-3-13(27)4-6-15/h3-12,34H,2H2,1H3,(H,35,36)
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n/an/an/an/a 495n/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