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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Translocator protein' and Ligand = 'BDBM50205314'   
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
Translocator protein


(Rattus norvegicus (rat))
BDBM50205314
PNG
(CHEMBL220641 | N-(5-fluoro-2-phenoxyphenyl)-N-(2-i...)
Show SMILES COc1ccc(I)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C22H19FINO3/c1-15(26)25(14-16-12-19(27-2)9-10-20(16)24)21-13-17(23)8-11-22(21)28-18-6-4-3-5-7-18/h3-13H,14H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.40n/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
Displacement of [11C]PK-11195 from PBR in Sprague-Dawley rat brain


J Med Chem 50: 848-55 (2007)


Article DOI: 10.1021/jm061127n
BindingDB Entry DOI: 10.7270/Q2B858XS
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50205314
PNG
(CHEMBL220641 | N-(5-fluoro-2-phenoxyphenyl)-N-(2-i...)
Show SMILES COc1ccc(I)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C22H19FINO3/c1-15(26)25(14-16-12-19(27-2)9-10-20(16)24)21-13-17(23)8-11-22(21)28-18-6-4-3-5-7-18/h3-13H,14H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.80n/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
Displacement of [11C]DAA1106 from PBR in Sprague-Dawley rat brain


J Med Chem 50: 848-55 (2007)


Article DOI: 10.1021/jm061127n
BindingDB Entry DOI: 10.7270/Q2B858XS
More data for this
Ligand-Target Pair