METHIONINE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: V03AB26
UNII: AE28F7PNPL

Structure
InChI Key FFEARJCKVFRZRR-BYPYZUCNSA-N
Smile CSCC[C@H](N)C(=O)O
InChI
InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H11NO2S
Molecular Weight 149.22
AlogP 0.15
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 63.32
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 9.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Lyase
- - - 61000 -
Enzyme Transferase
- - - - 2.675-25.63
Enzyme
- - - 26900000 2.675-25.63
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - -8.69-47.43
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC03 and SLC07 families of heteromeric amino acid transporters (HATs) SLC07 Cationic amino acid transporter/glycoprotein-associated family
- 170000-180000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hearing Loss, Noise-Induced 3 D006317 ClinicalTrials
Jaundice, Obstructive 3 D041781 ClinicalTrials
Hepatitis C, Chronic 2 D019698 ClinicalTrials
Ependymoma 2 D004806 ClinicalTrials
Craniopharyngioma 2 D003397 ClinicalTrials
Hot Flashes 2 D019584 ClinicalTrials
Glioblastoma 2 D005909 ClinicalTrials
Rhabdomyosarcoma 2 D012208 ClinicalTrials
Pulmonary Alveolar Proteinosis 1 D011649 ClinicalTrials
Abdominal Pain 1 D015746 ClinicalTrials
Carcinoma, Hepatocellular 1 D006528 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 63-68-3
ChEBI 57844
ChEMBL CHEMBL42336
DrugBank DB00134
DrugCentral 3347
EPA CompTox DTXSID5040548
FDA SRS AE28F7PNPL
Human Metabolome Database HMDB0000696
Guide to Pharmacology 4814
KEGG C00073
PDB MET
PharmGKB PA450423
PubChem 6137
SureChEMBL SCHEMBL4226
ZINC ZINC000001532529
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