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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Solute carrier family 15 member 1' and Ligand = 'BDBM50188492'   
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 15 member 1


(Rattus norvegicus)
BDBM50188492
PNG
((S)-2-(2-Amino-acetylamino)-4-methyl-pentanoic aci...)
Show SMILES CC(C)C[C@H](NC(=O)CN)C(O)=O
Show InChI InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t6-/m0/s1
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KEGG

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MCE
KEGG
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Article
PubMed
1.10E+5n/an/an/an/an/an/an/an/a



Kyoto University Hospital

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of Gly-Sar uptake in PEPT1-expressing LLC-PK1 cells


Pflugers Arch 440: 679-84 (2000)


Article DOI: 10.1007/s004240000339
BindingDB Entry DOI: 10.7270/Q2CR5X6C
More data for this
Ligand-Target Pair
Solute carrier family 15 member 1


(Homo sapiens (Human))
BDBM50188492
PNG
((S)-2-(2-Amino-acetylamino)-4-methyl-pentanoic aci...)
Show SMILES CC(C)C[C@H](NC(=O)CN)C(O)=O
Show InChI InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t6-/m0/s1
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Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to human PEPT1 assessed as inhibition of [14C]Gly-Sar uptake in MDCK cells


J Med Chem 49: 3636-44 (2006)


Article DOI: 10.1021/jm0511029
BindingDB Entry DOI: 10.7270/Q2P55P9R
More data for this
Ligand-Target Pair
Solute carrier family 15 member 1


(Homo sapiens (Human))
BDBM50188492
PNG
((S)-2-(2-Amino-acetylamino)-4-methyl-pentanoic aci...)
Show SMILES CC(C)C[C@H](NC(=O)CN)C(O)=O
Show InChI InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t6-/m0/s1
PDB

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KEGG

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CHEMBL
MCE
KEGG
MMDB
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PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 1.70E+5n/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human PEPT1 expressed in MDCK cells


J Med Chem 49: 3636-44 (2006)


Article DOI: 10.1021/jm0511029
BindingDB Entry DOI: 10.7270/Q2P55P9R
More data for this
Ligand-Target Pair