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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transthyretin' and Ligand = 'BDBM50241605'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transthyretin


(Homo sapiens (Human))
BDBM50241605
PNG
(CHEMBL4082603)
Show SMILES OB(O)c1ccc(\C=C\c2cccc(c2)C(O)=O)cc1
Show InChI InChI=1S/C15H13BO4/c17-15(18)13-3-1-2-12(10-13)5-4-11-6-8-14(9-7-11)16(19)20/h1-10,19-20H,(H,17,18)/b5-4+
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Similars

PDB
Article
PubMed
n/an/an/a 990n/an/an/an/an/a



University of Wisconsin-Madison

Curated by ChEMBL


Assay Description
Competitive binding affinity to human wild type TTR expressed in Escherichia coli BL-21 assessed as equilibrium dissociation constant of second site ...


J Med Chem 60: 7820-7834 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00952
BindingDB Entry DOI: 10.7270/Q26W9D7Z
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)