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Compile Data Set for Download or QSAR

Found 6 hits from Chung Shan Medical University Hospital   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232997
PNG
((S)-(-)-endo-2-norbornyl-N-n-butylcarbamate)
Show SMILES CCCCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C12H21NO2/c1-2-3-6-13-12(14)15-11-8-9-4-5-10(11)7-9/h9-11H,2-8H2,1H3,(H,13,14)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2 -11.9n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232998
PNG
((R)-(+)-endo-2-norbornyl-N-n-butylcarbamate | rac-...)
Show SMILES CCCCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C12H21NO2/c1-2-3-6-13-12(14)15-11-8-9-4-5-10(11)7-9/h9-11H,2-8H2,1H3,(H,13,14)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3 -11.6n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232998
PNG
((R)-(+)-endo-2-norbornyl-N-n-butylcarbamate | rac-...)
Show SMILES CCCCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C12H21NO2/c1-2-3-6-13-12(14)15-11-8-9-4-5-10(11)7-9/h9-11H,2-8H2,1H3,(H,13,14)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5 -11.3n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232995
PNG
((R)-(+)-exo-2-norbonyl-N-n-butylcarbamate)
Show SMILES CCCCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C12H21NO2/c1-2-3-6-13-12(14)15-11-8-9-4-5-10(11)7-9/h9-11H,2-8H2,1H3,(H,13,14)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
11 -10.8n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232999
PNG
(rac-()-exo-2-norbornyl carbamate)
Show SMILES CCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C10H17NO2/c1-2-11-10(12)13-9-6-7-3-4-8(9)5-7/h7-9H,2-6H2,1H3,(H,11,12)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
30 -10.3n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BChE)


(Equus caballus (Horse))
BDBM232996
PNG
((S)-(-)-exo-2-norbonyl-N-n-butylcarbamate)
Show SMILES CCCCNC(=O)OC1CC2CCC1C2
Show InChI InChI=1S/C12H21NO2/c1-2-3-6-13-12(14)15-11-8-9-4-5-10(11)7-9/h9-11H,2-8H2,1H3,(H,13,14)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
50 -9.95n/an/an/an/an/a7.025



Chung Shan Medical University Hospital



Assay Description
BChE inhibitions by the carbamate inhibitors were assayed by the Ellman method [Ellman et al., Biochem. Pharm., 7:88-95]. BChE-catalyzed hydrolysis o...


J Enzyme Inhib Med Chem 25: 13-20 (2010)


Article DOI: 10.3109/14756360902888200
BindingDB Entry DOI: 10.7270/Q2C8286J
More data for this
Ligand-Target Pair