Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetMalonyl-CoA decarboxylase, mitochondrial
LigandBDBM50190410
Substrate/Competitorn/a
Meas. Tech.ChEMBL_375433 (CHEMBL864146)
IC50 8±n/a nM
Citation Cheng, JFHuang, YPenuliar, RNishimoto, MLiu, LArrhenius, TYang, GO'leary, EBarbosa, MBarr, RDyck, JRLopaschuk, GDNadzan, AM Discovery of potent and orally available malonyl-CoA decarboxylase inhibitors as cardioprotective agents. J Med Chem49:4055-8 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Malonyl-CoA decarboxylase, mitochondrial
Name:Malonyl-CoA decarboxylase, mitochondrial
Synonyms:DCMC_HUMAN | MLYCD | Malonyl-CoA decarboxylase
Type:PROTEIN
Mol. Mass.:55018.37
Organism:Homo sapiens (Human)
Description:ChEMBL_665404
Residue:493
Sequence:
MRGFGPGLTARRLLPLRLPPRPPGPRLASGQAAGALERAMDELLRRAVPPTPAYELREKT
PAPAEGQCADFVSFYGGLAETAQRAELLGRLARGFGVDHGQVAEQSAGVLHLRQQQREAA
VLLQAEDRLRYALVPRYRGLFHHISKLDGGVRFLVQLRADLLEAQALKLVEGPDVREMNG
VLKGMLSEWFSSGFLNLERVTWHSPCEVLQKISEAEAVHPVKNWMDMKRRVGPYRRCYFF
SHCSTPGEPLVVLHVALTGDISSNIQAIVKEHPPSETEEKNKITAAIFYSISLTQQGLQG
VELGTFLIKRVVKELQREFPHLGVFSSLSPIPGFTKWLLGLLNSQTKEHGRNELFTDSEC
KEISEITGGPINETLKLLLSSSEWVQSEKLVRALQTPLMRLCAWYLYGEKHRGYALNPVA
NFHLQNGAVLWRINWMADVSLRGITGSCGLMANYRYFLEETGPNSTSYLGSKIIKASEQV
LSLVAQFQKNSKL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50190410
n/a
NameBDBM50190410
Synonyms:CHEMBL378459 | tert-butyl-(3R)-3-{[(5R)-5-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethyl-ethyl)-4,5-dihydro-isoxazole-3-carbonyl]-amino}-butanoate
TypeSmall organic molecule
Emp. Form.C15H20F6N2O5
Mol. Mass.422.3201
SMILESC[C@H](CC(=O)OC(C)(C)C)NC(=O)C1=NO[C@H](C1)C(O)(C(F)(F)F)C(F)(F)F |t:13|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: