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BDBM50142500 (2S)-2-amino-4-(methylsulfanyl)butanoic acid::(S)-2-amino-4-(methylthio)butanoic acid::(S)-2-amino-4-(methylthio)butyric acid::(S)-methionine::CHEMBL42336::L-(-)-methionine::L-Methionin::L-alpha-amino-gamma-methylmercaptobutyric acid::L-methionine

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

InChI Key: InChIKey=FFEARJCKVFRZRR-BYPYZUCNSA-N

Data: 3 KI  2 IC50

PDB links: 119 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 = 50142500   
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
S-ribosylhomocysteine lyase


(Bacillus subtilis)
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
PDB
MMDB

KEGG

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KEGG
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PC cid
PC sid
PDB
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Article
PubMed
6.10E+4n/an/an/an/an/an/an/an/a



The Ohio State University

Curated by ChEMBL


Assay Description
Inhibition of cobalt substituted Bacillus subtilis LuxS


J Med Chem 49: 3003-11 (2006)


Article DOI: 10.1021/jm060047g
BindingDB Entry DOI: 10.7270/Q25X28JQ
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
KEGG

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Article
PubMed
2.69E+7n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
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KEGG

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Article
PubMed
>1.50E+8n/an/an/an/an/an/an/an/a



Universit£ Pierre et Marie Curie

Curated by ChEMBL


Assay Description
Inhibition constant against Escherichia coli cyclopropane fatty acid synthase


Bioorg Med Chem Lett 14: 1661-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.051
BindingDB Entry DOI: 10.7270/Q26H4HZX
More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
PDB
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KEGG

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US Patent
n/an/a>6.00E+4n/an/an/an/an/an/a



CHINA PHARMACEUTICAL UNIVERSITY

US Patent


Assay Description
11.1 Preparation of Reagents and Standard Solutions(1) 75 mM phosphate buffer (PB, pH 7.4): containing KH2PO4 0.0956 g, K2HPO4 0.6946 g, EDTA 1.862 m...


US Patent US11021454 (2021)

More data for this
Ligand-Target Pair
Large neutral amino acids transporter small subunit 1


(Homo sapiens (Human))
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
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KEGG
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PC cid
PC sid
PDB
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Article
PubMed
n/an/a 1.70E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Cis-inhibition of human LAT1 expressed in TREx HEK293 cells at 200 uM assessed as inhibition of [3H]-gabapentin uptake preincubated for 3 mins at 37 ...


J Med Chem 61: 7358-7373 (2018)


Article DOI: 10.1021/acs.jmedchem.8b01007
BindingDB Entry DOI: 10.7270/Q2XK8J66
More data for this
Ligand-Target Pair