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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Monocarboxylate transporter 1' and Ligand = 'BDBM345317'   
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
Monocarboxylate transporter 1


(Homo sapiens (Human))
BDBM345317
PNG
(2-([1-[(4-methoxyphenyl)methyl]-5-[3-(2- methylpr...)
Show SMILES COc1ccc(Cn2nc(COC(C)(C)C(O)=O)cc2-c2cccc(OCC(C)C)c2)cc1
Show InChI InChI=1S/C26H32N2O5/c1-18(2)16-32-23-8-6-7-20(13-23)24-14-21(17-33-26(3,4)25(29)30)27-28(24)15-19-9-11-22(31-5)12-10-19/h6-14,18H,15-17H2,1-5H3,(H,29,30)
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PC cid
PC sid
UniChem
US Patent
n/an/a 1.70E+4n/an/an/an/an/an/a



Vettore, LLC

US Patent


Assay Description
MCT1 activity may be measured using BT-20 breast cancer cells that express high native levels of MCT1, but do not express MCT4 and are known to those...


US Patent US10214492 (2019)


BindingDB Entry DOI: 10.7270/Q2Q81GC0
More data for this
Ligand-Target Pair
Monocarboxylate transporter 1


(Homo sapiens (Human))
BDBM345317
PNG
(2-([1-[(4-methoxyphenyl)methyl]-5-[3-(2- methylpr...)
Show SMILES COc1ccc(Cn2nc(COC(C)(C)C(O)=O)cc2-c2cccc(OCC(C)C)c2)cc1
Show InChI InChI=1S/C26H32N2O5/c1-18(2)16-32-23-8-6-7-20(13-23)24-14-21(17-33-26(3,4)25(29)30)27-28(24)15-19-9-11-22(31-5)12-10-19/h6-14,18H,15-17H2,1-5H3,(H,29,30)
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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
n/an/a 1.70E+4n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2CR5ZGC
More data for this
Ligand-Target Pair
Monocarboxylate transporter 1


(Homo sapiens (Human))
BDBM345317
PNG
(2-([1-[(4-methoxyphenyl)methyl]-5-[3-(2- methylpr...)
Show SMILES COc1ccc(Cn2nc(COC(C)(C)C(O)=O)cc2-c2cccc(OCC(C)C)c2)cc1
Show InChI InChI=1S/C26H32N2O5/c1-18(2)16-32-23-8-6-7-20(13-23)24-14-21(17-33-26(3,4)25(29)30)27-28(24)15-19-9-11-22(31-5)12-10-19/h6-14,18H,15-17H2,1-5H3,(H,29,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.70E+4n/an/an/an/an/an/a


TBA

Assay Description
MCT1 activity may be measured using BT-20 breast cancer cells that express high native levels of MCT1, but do not express MCT4 and are known to those...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2862KNG
More data for this
Ligand-Target Pair