Reaction Details Report a problem with these data
Target
Gamma-butyrobetaine dioxygenase
Ligand
BDBM50193145
Substrate
n/a
Meas. Tech.
ChEMBL_1434774 (CHEMBL3383443)
Kd
122000±n/a nM
Citation
 Rydzik, AM; Brem, J; Struwe, WB; Kochan, GT; Benesch, JL; Schofield, CJ Ejection of structural zinc leads to inhibition of¿-butyrobetaine hydroxylase. Bioorg Med Chem Lett 24:4954-7 (2014) [PubMed]  Article 
Target
Name:
Gamma-butyrobetaine dioxygenase
Synonyms:
BBH | BBOX | BBOX1 | BODG_HUMAN | Gamma-BBH | Gamma-butyrobetaine hydroxylase | Gamma-butyrobetaine,2-oxoglutarate dioxygenase
Type:
PROTEIN
Mol. Mass.:
44715.93
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1434107
Residue:
387
Sequence:
MACTIQKAEALDGAHLMQILWYDEEESLYPAVWLRDNCPCSDCYLDSAKARKLLVEALDVNIGIKGLIFDRKKVYITWPDEHYSEFQADWLKKRCFSKQARAKLQRELFFPECQYWGSELQLPTLDFEDVLRYDEHAYKWLSTLKKVGIVRLTGASDKPGEVSKLGKRMGFLYLTFYGHTWQVQDKIDANNVAYTTGKLSFHTDYPALHHPPGVQLLHCIKQTVTGGDSEIVDGFNVCQKLKKNNPQAFQILSSTFVDFTDIGVDYCDFSVQSKHKIIELDDKGQVVRINFNNATRDTIFDVPVERVQPFYAALKEFVDLMNSKESKFTFKMNPGDVITFDNWRLLHGRRSYEAGTEISRHLEGAYADWDVVMSRLRILRQRVENGN
  
Inhibitor
Name:
BDBM50193145
Synonyms:
2-(1-chloro-4-hydroxyisoquinoline-3-carboxamido)acetic acid | CHEMBL426560 | Isoquinoline 3 | N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE
Type:
Small organic molecule
Emp. Form.:
C12H9ClN2O4
Mol. Mass.:
280.664
SMILES:
OC(=O)CNC(=O)c1nc(Cl)c2ccccc2c1O
Structure:
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