Reaction Details Report a problem with these data
Target
Acyl-protein thioesterase 1
Ligand
BDBM50011918
Substrate
n/a
Meas. Tech.
ChEBML_100183
IC50
115000±n/a nM
Citation
Mingeot-Leclercq, MP; Van Schepdael, A; Brasseur, R; Busson, R; Vanderhaeghe, HJ; Claes, PJ; Tulkens, PM New derivatives of kanamycin B obtained by modifications and substitutions in position 6''. 2. In vitro and computer-aided toxicological evaluation with respect to interactions with phosphatidylinositol. J Med Chem 34:1476-82 (1991) [PubMed] Article
More Info.:
Target
Name:
Acyl-protein thioesterase 1
Synonyms:
Acyl-protein thioesterase 1/2 | Apt1 | LYPA1_RAT | Lypla1 | Lysosomal phospholipase A1
Type:
PROTEIN
Mol. Mass.:
24708.49
Organism:
Rattus norvegicus
Description:
ChEMBL_12731
Residue:
230
Sequence:
MCGNNMSAPMPAVVPAARKATAAVIFLHGLGDTGHGWAEAFAGIKSSHIKYICPHAPVMPVTLNMSMMMPSWFDIIGLSPDSQEDESGIKQAAETVKALIDQEVKNGIPSNRIILGGFSQGGALSLYTALTTQQKLAGVTALSCWLPLRASFSQGPINSANRDISVLQCHGDCDPLVPLMFGSLTVERLKGLVNPANVTFKVYEGMMHSSCQQEMMDVKYFIDKLLPPID
Inhibitor
Name:
BDBM50011918
Synonyms:
CHEMBL415861 | N-{4-Amino-6-[4,6-diamino-3-(3-amino-6-aminomethyl-4,5-dihydroxy-tetrahydro-pyran-2-yloxy)-2-hydroxy-cyclohexyloxy]-3,5-dihydroxy-tetrahydro-pyran-2-ylmethyl}-N-methyl-butyramide
Type:
Small organic molecule
Emp. Form.:
C23H46N6O10
Mol. Mass.:
566.6455
SMILES:
CCCC(=O)N(C)CC1OC(OC2C(N)CC(N)C(OC3OC(CN)C(O)C(O)C3N)C2O)C(O)C(N)C1O