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Target
Betaine--homocysteine S-methyltransferase 1
Ligand
BDBM50268031
Substrate
n/a
Meas. Tech.
ChEMBL_520155 (CHEMBL947843)
IC50
3260±n/a nM
Citation
 Vanek, V; Budesínský, M; Kabeleová, P; Sanda, M; Kozísek, M; Hanclová, I; Mládková, J; Brynda, J; Rosenberg, I; Koutmos, M; Garrow, TA; Jirácek, J Structure-activity study of new inhibitors of human betaine-homocysteine S-methyltransferase. J Med Chem 52:3652-65 (2009) [PubMed]  Article 
Target
Name:
Betaine--homocysteine S-methyltransferase 1
Synonyms:
BHMT | BHMT1_HUMAN
Type:
PROTEIN
Mol. Mass.:
45000.99
Organism:
Homo sapiens (Human)
Description:
ChEMBL_970672
Residue:
406
Sequence:
MPPVGGKKAKKGILERLNAGEIVIGDGGFVFALEKRGYVKAGPWTPEAAVEHPEAVRQLHREFLRAGSNVMQTFTFYASEDKLENRGNYVLEKISGQEVNEAACDIARQVADEGDALVAGGVSQTPSYLSCKSETEVKKVFLQQLEVFMKKNVDFLIAEYFEHVEEAVWAVETLIASGKPVAATMCIGPEGDLHGVPPGECAVRLVKAGASIIGVNCHFDPTISLKTVKLMKEGLEAARLKAHLMSQPLAYHTPDCNKQGFIDLPEFPFGLEPRVATRWDIQKYAREAYNLGVRYIGGCCGFEPYHIRAIAEELAPERGFLPPASEKHGSWGSGLDMHTKPWVRARARKEYWENLRIASGRPYNPSMSKPDGWGVTKGTAELMQQKEATTEQQLKELFEKQKFKSQ
  
Inhibitor
Name:
BDBM50268031
Synonyms:
(RS)-2-Amino-4-[(2-carboxyethylthio)methylthio]butanoic Acid | CHEMBL448691
Type:
Small organic molecule
Emp. Form.:
C8H15NO4S2
Mol. Mass.:
253.339
SMILES:
NC(CCSCSCCC(O)=O)C(O)=O
Structure:
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