Target
Acylcarnitine hydrolase
Ligand
BDBM50409664
Substrate
n/a
Meas. Tech.
ChEMBL_216226 (CHEMBL823860)
IC50
1778279.41±n/a nM
Citation
 Wheelock, CEColvin, MEUemura, IOlmstead, MMSanborn, JRNakagawa, YJones, ADHammock, BD Use of ab initio calculations to predict the biological potency of carboxylesterase inhibitors. J Med Chem 45:5576-93 (2002) [PubMed]  Article 
Target
Name:
Acylcarnitine hydrolase
Synonyms:
Carboxylesterase 2 | Ces2 | Ces2c | EST2C_MOUSE
Type:
PROTEIN
Mol. Mass.:
62457.35
Organism:
Mus musculus
Description:
ChEMBL_216226
Residue:
561
Sequence:
MTRNQLHNWLNAGFFGLLLLLIHVQGQDSPEANPIRNTHTGQIQGSLIHVKDTKAGVHTFLGIPFAKPPVGPLRFAPPEAPEPWSGVRDGTAHPAMCLQNLDMLNEAGLPDMKMMLSSFPMSEDCLYLNIYTPAHAHEGSNLPVMVWIHGGALVIGMASMFDGSLLTVNEDLVVVTIQYRLGVLGFFSTGDQHARGNWGYLDQAAALRWVQQNIAHFGGNPDRVTIFGESAGGTSVSSHVVSPMSQGLFHGAIMESGVALLPDLISETSEMVSTTVAKLSGCEAMDSQALVRCLRGKSEAEILAINKVFKMIPAVVDGEFFPRHPKELLASEDFHPVPSIIGVNNDEFGWSIPVVMGSAQMIKGITRENLQAVLKDTAVQMMLPPECSDLLMEEYMGDTEDAQTLQIQFTEMMGDFMFVIPALQVAHFQRSHAPVYFYEFQHPPSYFKDVRPPHVKADHADEIPFVFASFFWGMKLDFTEEEELLSRRMMKYWANFARHGNPNSEGLPYWPVMDHDEQYLQLDIQPAVGRALKAGRLQFWTKTLPQKIQELKASQDKHREL
  
Inhibitor
Name:
BDBM50409664
Synonyms:
CHEMBL153601
Type:
Small organic molecule
Emp. Form.:
C10H19FO
Mol. Mass.:
174.2557
SMILES:
CCCCCCCCC(=O)CF
Structure:
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