Reaction Details Report a problem with these data
Target
Neutral cholesterol ester hydrolase 1
Ligand
BDBM50390523
Substrate
n/a
Meas. Tech.
ChEMBL_835312 (CHEMBL2072018)
IC50
920±n/a nM
Citation
 Shreder, KR; Lin, EC; Wu, J; Cajica, J; Amantea, CM; Hu, Y; Okerberg, E; Brown, HE; Pham, LM; Chung, de M; Fraser, AS; McGee, E; Rosenblum, JS; Kozarich, JW Synthesis and structure-activity relationship of (1-halo-2-naphthyl) carbamate-based inhibitors of KIAA1363 (NCEH1/AADACL1). Bioorg Med Chem Lett 22:5748-51 (2012) [PubMed]  Article 
Target
Name:
Neutral cholesterol ester hydrolase 1
Synonyms:
AADACL1 | KIAA1363 | NCEH1 | NCEH1_HUMAN
Type:
PROTEIN
Mol. Mass.:
45810.81
Organism:
Homo sapiens (Human)
Description:
ChEMBL_835312
Residue:
408
Sequence:
MRSSCVLLTALVALAAYYVYIPLPGSVSDPWKLMLLDATFRGAQQVSNLIHYLGLSHHLLALNFIIVSFGKKSAWSSAQVKVTDTDFDGVEVRVFEGPPKPEEPLKRSVVYIHGGGWALASAKIRYYDELCTAMAEELNAVIVSIEYRLVPKVYFPEQIHDVVRATKYFLKPEVLQKYMVDPGRICISGDSAGGNLAAALGQQFTQDASLKNKLKLQALIYPVLQALDFNTPSYQQNVNTPILPRYVMVKYWVDYFKGNYDFVQAMIVNNHTSLDVEEAAAVRARLNWTSLLPASFTKNYKPVVQTTGNARIVQELPQLLDARSAPLIADQAVLQLLPKTYILTCEHDVLRDDGIMYAKRLESAGVEVTLDHFEDGFHGCMIFTSWPTNFSVGIRTRNSYIKWLDQNL
  
Inhibitor
Name:
BDBM50390523
Synonyms:
CHEMBL2071646
Type:
Small organic molecule
Emp. Form.:
C21H25BrN2O3
Mol. Mass.:
433.339
SMILES:
CN(C)C(=O)Oc1ccc2cc(ccc2c1Br)C(=O)NC1CCCCCC1
Structure:
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