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PubMed code 12538807

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
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
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420202
PNG
(CHEMBL2074987)
Show SMILES N[C@H](CSc1nc2ccccc2s1)C(O)=O |r|
Show InChI InChI=1S/C10H10N2O2S2/c11-6(9(13)14)5-15-10-12-7-3-1-2-4-8(7)16-10/h1-4,6H,5,11H2,(H,13,14)/t6-/m1/s1
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PC cid
PC sid
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Article
PubMed
n/an/a 9.90E+3n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: trans-stimulation in OAT1-COS7 cells


J Pharmacol Exp Ther 304: 560-6 (2003)


Article DOI: 10.1124/jpet.102.043455
BindingDB Entry DOI: 10.7270/Q2NK3G9B
More data for this
Ligand-Target Pair
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420203
PNG
(CHEMBL2074983)
Show SMILES N[C@@H](CSc1nc2ccccc2s1)C(O)=O |r|
Show InChI InChI=1S/C10H10N2O2S2/c11-6(9(13)14)5-15-10-12-7-3-1-2-4-8(7)16-10/h1-4,6H,5,11H2,(H,13,14)/t6-/m0/s1
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CHEMBL
MCE
KEGG
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Article
PubMed
n/an/a 9.90E+3n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of PAH uptake in OAT1-expressing CHO cells


J Pharmacol Exp Ther 304: 560-6 (2003)


Article DOI: 10.1124/jpet.102.043455
BindingDB Entry DOI: 10.7270/Q2NK3G9B
More data for this
Ligand-Target Pair
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420204
PNG
(CHEMBL2074985)
Show SMILES N[C@H](CSC(F)(F)C(F)Cl)C(O)=O |r|
Show InChI InChI=1S/C5H7ClF3NO2S/c6-4(7)5(8,9)13-1-2(10)3(11)12/h2,4H,1,10H2,(H,11,12)/t2-,4?/m1/s1
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n/an/a 1.77E+5n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of PAH uptake in OAT1-COS7 cells


J Pharmacol Exp Ther 304: 560-6 (2003)


Article DOI: 10.1124/jpet.102.043455
BindingDB Entry DOI: 10.7270/Q2NK3G9B
More data for this
Ligand-Target Pair
Solute carrier family 22 member 6


(Homo sapiens (Human))
BDBM50420201
PNG
(CHEMBL2074986)
Show SMILES N[C@H](CS\C(Cl)=C\Cl)C(O)=O |r|
Show InChI InChI=1S/C5H7Cl2NO2S/c6-1-4(7)11-2-3(8)5(9)10/h1,3H,2,8H2,(H,9,10)/b4-1+/t3-/m1/s1
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.08E+5n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of PAH uptake in OAT1-COS7 cells


J Pharmacol Exp Ther 304: 560-6 (2003)


Article DOI: 10.1124/jpet.102.043455
BindingDB Entry DOI: 10.7270/Q2NK3G9B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%