Reaction Details Report a problem with these data
Target
Neutral cholesterol ester hydrolase 1
Ligand
BDBM50448896
Substrate
n/a
Meas. Tech.
ChEMBL_1296364 (CHEMBL3129774)
IC50
>100000±n/a nM
Citation
 Otrubova, K; Cravatt, BF; Boger, DL Design, synthesis, and characterization ofa-ketoheterocycles that additionally target the cytosolic port Cys269 of fatty acid amide hydrolase. J Med Chem 57:1079-89 (2014) [PubMed]  Article 
Target
Name:
Neutral cholesterol ester hydrolase 1
Synonyms:
Aadacl1 | Arylacetamide deacetylase-like 1 | CPO-BP | Chlorpyrifos oxon-binding protein | Kiaa1363 | NCEH | NCEH1_MOUSE | Nceh1 | Neutral cholesterol ester hydrolase
Type:
Single-pass type II membrane protein; hydrolase
Mol. Mass.:
45742.11
Organism:
Mus musculus (mouse)
Description:
Assays were using membranes of recombinant KIAA1363 transiently transfected in COS-7 cells.
Residue:
408
Sequence:
MRSSCVLLAALLALAAYYVYIPLPSAVSDPWKLMLLDATFRGAQQVSNLIHSLGLNHHLIALNFIITSFGKQSARSSPKVKVTDTDFDGVEVRVFEGSPKPEEPLRRSVIYIHGGGWALASAKISYYDQLCTTMAEELNAVIVSIEYRLVPQVYFPEQIHDVIRATKYFLQPEVLDKYKVDPGRVGISGDSAGGNLAAALGQQFTYVASLKNKLKLQALVYPVLQALDFNTPSYQQSMNTPILPRHVMVRYWLDYFKGNYDFVEAMIVNNHTSLDVERAAALRARLDWTSLLPSSIKKNYKPIMQTTGNARIVQEIPQLLDAAASPLIAEQEVLEALPKTYILTCEHDVLRDDGIMYAKRLESAGVNVTLDHFEDGFHGCMIFTSWPTNFSVGIRTRNSYIKWLDQNL
  
Inhibitor
Name:
BDBM50448896
Synonyms:
CHEMBL3125307
Type:
Small organic molecule
Emp. Form.:
C23H23N3O2
Mol. Mass.:
373.4476
SMILES:
O=C(CCCCCCc1ccccc1)c1ncc(o1)-c1ccc(CC#N)cn1
Structure:
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