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BDBM50188484 CHEMBL54278::Gly-Gly-Gly::[2-(2-Amino-acetylamino)-acetylamino]-acetic acid::glycylglycylglycine

SMILES: NCC(=O)NCC(=O)NCC(O)=O

InChI Key: InChIKey=XKUKSGPZAADMRA-UHFFFAOYSA-N

Data: 2 KI  2 IC50  1 EC50

PDB links: 4 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50188484   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Oligopeptide transporter, kidney isoform


(Rattus norvegicus)
BDBM50188484
PNG
(CHEMBL54278 | Gly-Gly-Gly | [2-(2-Amino-acetylamin...)
Show SMILES NCC(=O)NCC(=O)NCC(O)=O
Show InChI InChI=1S/C6H11N3O4/c7-1-4(10)8-2-5(11)9-3-6(12)13/h1-3,7H2,(H,8,10)(H,9,11)(H,12,13)
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1.60E+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 PEPT2-expressing LLC-PK1 cells


Pflugers Arch 440: 679-84 (2000)


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


(Rattus norvegicus)
BDBM50188484
PNG
(CHEMBL54278 | Gly-Gly-Gly | [2-(2-Amino-acetylamin...)
Show SMILES NCC(=O)NCC(=O)NCC(O)=O
Show InChI InChI=1S/C6H11N3O4/c7-1-4(10)8-2-5(11)9-3-6(12)13/h1-3,7H2,(H,8,10)(H,9,11)(H,12,13)
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CHEMBL
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PubMed
1.30E+6n/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)


BindingDB Entry DOI: 10.7270/Q2CR5X6C
More data for this
Ligand-Target Pair
Oligopeptide transporter small intestine isoform


(Homo sapiens (Human))
BDBM50188484
PNG
(CHEMBL54278 | Gly-Gly-Gly | [2-(2-Amino-acetylamin...)
Show SMILES NCC(=O)NCC(=O)NCC(O)=O
Show InChI InChI=1S/C6H11N3O4/c7-1-4(10)8-2-5(11)9-3-6(12)13/h1-3,7H2,(H,8,10)(H,9,11)(H,12,13)
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n/an/a 1.40E+6n/an/an/an/an/an/a



University of California San Francisco

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of Gly-Sar uptake (Gly-Sar: 25000 uM) in PEPT1-expressing CHO cells


Pharm Res 13: 1631-4 (1996)


BindingDB Entry DOI: 10.7270/Q2TM7DZF
More data for this
Ligand-Target Pair
Oligopeptide transporter small intestine isoform


(Homo sapiens (Human))
BDBM50188484
PNG
(CHEMBL54278 | Gly-Gly-Gly | [2-(2-Amino-acetylamin...)
Show SMILES NCC(=O)NCC(=O)NCC(O)=O
Show InChI InChI=1S/C6H11N3O4/c7-1-4(10)8-2-5(11)9-3-6(12)13/h1-3,7H2,(H,8,10)(H,9,11)(H,12,13)
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Article
PubMed
n/an/an/an/a 5.80E+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
Oligopeptide transporter small intestine isoform


(Homo sapiens (Human))
BDBM50188484
PNG
(CHEMBL54278 | Gly-Gly-Gly | [2-(2-Amino-acetylamin...)
Show SMILES NCC(=O)NCC(=O)NCC(O)=O
Show InChI InChI=1S/C6H11N3O4/c7-1-4(10)8-2-5(11)9-3-6(12)13/h1-3,7H2,(H,8,10)(H,9,11)(H,12,13)
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CHEBI
CHEMBL
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Article
PubMed
n/an/a 1.07E+6n/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