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Target
Betaine--homocysteine S-methyltransferase 1
Ligand
BDBM50268055
Substrate
n/a
Meas. Tech.
ChEMBL_520155 (CHEMBL947843)
IC50
2500±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:
BDBM50268055
Synonyms:
(RS)-2-Amino-4-{2-[(carboxymethyl)(methyl)amino]ethylthio}-butanoic Acid | CHEMBL487301
Type:
Small organic molecule
Emp. Form.:
C9H18N2O4S
Mol. Mass.:
250.315
SMILES:
CN(CCSCCC(N)C(O)=O)CC(O)=O
Structure:
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