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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50336394   
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
Bile acid receptor


(Homo sapiens (Human))
BDBM50336394
PNG
(CHEMBL1668253 | rac-2-(2-(2-(4-chlorophenyl)-5,6-d...)
Show SMILES Cc1nc(NC(=O)C(C2CCCCC2)n2c(nc3cc(F)c(F)cc23)-c2ccc(Cl)cc2)sc1C(O)=O
Show InChI InChI=1S/C26H23ClF2N4O3S/c1-13-22(25(35)36)37-26(30-13)32-24(34)21(14-5-3-2-4-6-14)33-20-12-18(29)17(28)11-19(20)31-23(33)15-7-9-16(27)10-8-15/h7-12,14,21H,2-6H2,1H3,(H,35,36)(H,30,32,34)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of radioligand from human FXR by scintillation proximity assay


Bioorg Med Chem Lett 21: 1134-40 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.123
BindingDB Entry DOI: 10.7270/Q2MS3T1N
More data for this
Ligand-Target Pair