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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50143301   
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
Sodium- and chloride-dependent creatine transporter 1


(Rattus norvegicus)
BDBM50143301
PNG
((2-Hydroxy-ethyl)-dimethyl-octyl-ammonium | CHEMBL...)
Show SMILES CCCCCCCC[N+](C)(C)CCO
Show InChI InChI=1S/C12H28NO/c1-4-5-6-7-8-9-10-13(2,3)11-12-14/h14H,4-12H2,1-3H3/q+1
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UniProtKB/SwissProt

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PC cid
PC sid
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Similars

Article
PubMed
2.10E+3n/an/an/an/an/an/an/an/a



Texas Tech University Health Sciences Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]choline brain uptake through choline transporter was determined in situ brain perfusion studies in Male Fischer-344 rats


Bioorg Med Chem Lett 14: 3085-92 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.020
BindingDB Entry DOI: 10.7270/Q2BG2PJR
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent creatine transporter 1


(Rattus norvegicus)
BDBM50143301
PNG
((2-Hydroxy-ethyl)-dimethyl-octyl-ammonium | CHEMBL...)
Show SMILES CCCCCCCC[N+](C)(C)CCO
Show InChI InChI=1S/C12H28NO/c1-4-5-6-7-8-9-10-13(2,3)11-12-14/h14H,4-12H2,1-3H3/q+1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.00E+4n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Binding affinity towards blood brain barrier choline transporter at 10 microM using rat brain


Bioorg Med Chem Lett 14: 1869-74 (2004)


Article DOI: 10.1016/j.bmcl.2003.10.074
BindingDB Entry DOI: 10.7270/Q21N80JP
More data for this
Ligand-Target Pair