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BDBM50188521 (S)-2-((S)-2-Amino-3-methyl-butyrylamino)-3-methyl-butyric acid::2-(2-Amino-3-methyl-butyrylamino)-3-methyl-butyric acid::CHEMBL54552::Val-Val

SMILES: CC(C)[C@H](N)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key: InChIKey=KRNYOVHEKOBTEF-YUMQZZPRSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50188521   
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 small intestine isoform


(Homo sapiens)
BDBM50188521
PNG
((S)-2-((S)-2-Amino-3-methyl-butyrylamino)-3-methyl...)
Show SMILES CC(C)[C@H](N)C(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C10H20N2O3/c1-5(2)7(11)9(13)12-8(6(3)4)10(14)15/h5-8H,11H2,1-4H3,(H,12,13)(H,14,15)/t7-,8-/m0/s1
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CHEMBL
MMDB
PC cid
PC sid
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Similars

Article
PubMed
n/an/a 2.10E+5n/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)

More data for this
Ligand-Target Pair
Oligopeptide transporter small intestine isoform


(Homo sapiens)
BDBM50188521
PNG
((S)-2-((S)-2-Amino-3-methyl-butyrylamino)-3-methyl...)
Show SMILES CC(C)[C@H](N)C(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C10H20N2O3/c1-5(2)7(11)9(13)12-8(6(3)4)10(14)15/h5-8H,11H2,1-4H3,(H,12,13)(H,14,15)/t7-,8-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 7.00E+4n/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)

More data for this
Ligand-Target Pair