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BDBM50163900 (E)-3-[4-(3-Isopropyl-1H-indol-5-yloxy)-3,5-bis-trifluoromethyl-phenyl]-acrylic acid::CHEMBL182735

SMILES: CC(C)c1c[nH]c2ccc(Oc3c(cc(\C=C\C(O)=O)cc3C(F)(F)F)C(F)(F)F)cc12

InChI Key: InChIKey=ZOZISPMEYNRQNA-ZZXKWVIFSA-N

Data: 1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50163900   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thyroid Hormone Receptor (TR-alpha)/(TR-beta)


(Homo sapiens (Human))
BDBM50163900
PNG
((E)-3-[4-(3-Isopropyl-1H-indol-5-yloxy)-3,5-bis-tr...)
Show SMILES CC(C)c1c[nH]c2ccc(Oc3c(cc(\C=C\C(O)=O)cc3C(F)(F)F)C(F)(F)F)cc12
Show InChI InChI=1S/C22H17F6NO3/c1-11(2)15-10-29-18-5-4-13(9-14(15)18)32-20-16(21(23,24)25)7-12(3-6-19(30)31)8-17(20)22(26,27)28/h3-11,29H,1-2H3,(H,30,31)/b6-3+
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/an/a 3.20n/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