Reaction Details Report a problem with these data
Target
Choline O-acetyltransferase
Ligand
BDBM50048110
Substrate
n/a
Meas. Tech.
ChEMBL_49259 (CHEMBL661479)
Ki
25000000±n/a nM
Citation
 Patel, PJ; Messer, WS; Hudson, RA Inhibition and inactivation of presynaptic cholinergic markers using redox-reactive choline analogs. J Med Chem 36:1893-901 (1993) [PubMed]  Article 
Target
Name:
Choline O-acetyltransferase
Synonyms:
CLAT_RAT | Chat | Choline Acetyltransferase | Choline O-acetyltransferase | Choline acetylase
Type:
Enzyme Catalytic Domain
Mol. Mass.:
71875.58
Organism:
RAT
Description:
Choline Acetyltransferase 0 RAT::P32738
Residue:
640
Sequence:
MPILEKAPQKMPVKASSWEELDLPKLPVPPLQQTLATYLQCMQHLVPEEQFRKSQAIVKRFGAPGGLGETLQEKLLERQEKTANWVSEYWLNDMYLNNRLALPVNSSPAVIFARQHFQDTNDQLRFAACLISGVLSYKTLLDSHSLPTDWAKGQLSGQPLCMKQYYRLFSSYRLPGHTQDTLVAQKSSIMPEPEHVIVACCNQFFVLDVVINFRRLSEGDLFTQLRKIVKMASNEDERLPPIGLLTSDGRSEWAKARTVLLKDSTNRDSLDMIERCICLVCLDGPGTGELSDTHRALQLLHGGGCSLNGANRWYDKSLQFVVGRDGTCGVVCEHSPFDGIVLVQCTEHLLKHMMTSNKKLVRADSVSELPAPRRLRLKCSPETQGHLASSAEKLQRIVKNLDFIVYKFDNYGKTFIKKQKYSPDGFIQVALQLAYYRLYQRLVPTYESASIRRFQEGRVDNIRSATPEALAFVQAMTDHKAAMPASEKLQLLQTAMQAHKQYTVMAITGMAIDNHLLALRELARDLCKEPPEMFMDETYLMSNRFVLSTSQVPTTMEMFCCYGPVVPNGNGACYNPQPEAITFCISSFHSCKETSSVEFAEAVGASLVDMRDLCSSRQPADSKPPAPKEKARGPSQAKQS
  
Inhibitor
Name:
BDBM50048110
Synonyms:
CHEMBL57055 | [2-(3,4-Dihydroxy-phenyl)-2-hydroxy-ethyl]-trimethyl-ammonium; iodide
Type:
Small organic molecule
Emp. Form.:
C11H18NO3
Mol. Mass.:
212.265
SMILES:
C[N+](C)(C)CC(O)c1ccc(O)c(O)c1
Structure:
Search PDB for entries with ligand similarity: