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Target
Indolethylamine N-methyltransferase
Ligand
BDBM50378739
Substrate
n/a
Meas. Tech.
ChEMBL_2228241 (CHEMBL5141754)
IC50
4000±n/a nM
Citation
 Yoshida, S; Uehara, S; Kondo, N; Takahashi, Y; Yamamoto, S; Kameda, A; Kawagoe, S; Inoue, N; Yamada, M; Yoshimura, N; Tachibana, Y Peptide-to-Small Molecule: A Pharmacophore-Guided Small Molecule Lead Generation Strategy from High-Affinity Macrocyclic Peptides. J Med Chem 65:10655-10673 (2022) [PubMed] 
Target
Name:
Indolethylamine N-methyltransferase
Synonyms:
Amine N-methyltransferase | Aromatic alkylamine N-methyltransferase | Arylamine N-methyltransferase | INMT | INMT_HUMAN | Indolamine N-methyltransferase
Type:
PROTEIN
Mol. Mass.:
28884.19
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1333668
Residue:
263
Sequence:
MKGGFTGGDEYQKHFLPRDYLATYYSFDGSPSPEAEMLKFNLECLHKTFGPGGLQGDTLIDIGSGPTIYQVLAACDSFQDITLSDFTDRNREELEKWLKKEPGAYDWTPAVKFACELEGNSGRWEEKEEKLRAAVKRVLKCDVHLGNPLAPAVLPLADCVLTLLAMECACCSLDAYRAALCNLASLLKPGGHLVTTVTLRLPSYMVGKREFSCVALEKEEVEQAVLDAGFDIEQLLHSPQSYSVTNAANNGVCFIVARKKPGP
  
Inhibitor
Name:
BDBM50378739
Synonyms:
SINEFUNGIN | jm2c00120, Sinefungin
Type:
Small organic molecule
Emp. Form.:
C15H23N7O5
Mol. Mass.:
381.387
SMILES:
N[C@@H](CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
Structure:
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