Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetLiver carboxylesterase 1
LigandBDBM22833
Substrate/CompetitorBDBM22723
Meas. Tech.Enzyme Inhibition Assay
Ki 760±n/a nM
Citation Hyatt, JLMoak, THatfield, MJTsurkan, LEdwards, CCWierdl, MDanks, MKWadkins, RMPotter, PM Selective inhibition of carboxylesterases by isatins, indole-2,3-diones. J Med Chem50:1876-85 (2007) [PubMed]  Article
More Info.:Get all data from this article,   Solution Info,  Assay Method
 
Liver carboxylesterase 1
Name:Liver carboxylesterase 1
Synonyms:Carboxylesterase 1 | EST1_RABIT | liver carboxylesterase 1 | rCE
Type:Enzyme
Mol. Mass.:62292
Organism:Oryctolagus cuniculus (rabbit)
Description:n/a
Residue:565
Sequence:
MWLCALALASLAACTAWGHPSAPPVVDTVHGKVLGKFVSLEGFAQPVAVFLGVPFAKPPL
GSLRFAPPQPAESWSHVKNTTSYPPMCSQDAVSGHMLSELFTNRKENIPLKFSEDCLYLN
IYTPADLTKRGRLPVMVWIHGGGLMVGGASTYDGLALSAHENVVVVTIQYRLGIWGFFST
GDEHSRGNWGHLDQVAALRWVQDNIANFGGDPGSVTIFGESAGGQSVSILLLSPLTKNLF
HRAISESGVALLSSLFRKNTKSLAEKIAIEAGCKTTTSAVMVHCLRQKTEEELMEVTLKM
KFMALDLVGDPKENTAFLTTVIDGVLLPKAPAEILAEKKYNMLPYMVGINQQEFGWIIPM
QMLGYPLSEGKLDQKTATELLWKSYPIVNVSKELTPVATEKYLGGTDDPVKKKDLFLDML
ADLLFGVPSVNVARHHRDAGAPTYMYEYRYRPSFSSDMRPKTVIGDHGDEIFSVLGAPFL
KEGATEEEIKLSKMVMKYWANFARNGNPNGEGLPQWPAYDYKEGYLQIGATTQAAQKLKD
KEVAFWTELWAKEAARPRETEHIEL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM22833
BDBM22723
NameBDBM22833
Synonyms:5,7-dichloro-2,3-dihydro-1H-indole-2,3-dione | Isatin-based compound, 53 | cid_80771
TypeSmall organic molecule
Emp. Form.C8H3Cl2NO2
Mol. Mass.216.021
SMILESClc1cc2C(=O)C(=O)Nc2c(Cl)c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: