new BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 7 hits with Last Name = 'bunyapaiboonsri' and Initial = 't'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase (AChE)


(Torpedo marmorata (Marbled electric ray))
BDBM82305
PNG
(Terephthalaldehyde, 4-I-4)
Show SMILES O=C(C[n+]1ccccc1)NN=Cc1ccc(C=NNC(=O)C[n+]2ccccc2)cc1 |w:10.10,16.16|
Show InChI InChI=1S/C22H20N6O2/c29-21(17-27-11-3-1-4-12-27)25-23-15-19-7-9-20(10-8-19)16-24-26-22(30)18-28-13-5-2-6-14-28/h1-16H,17-18H2/p+2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 2.30n/an/an/an/a4.025



Université Louis Pasteur



Assay Description
The inhibitory activity of the equilibrated mixtures was determined. The activity of AChE was monitored by following the linear change in absorbance...


Chembiochem 2: 438-44 (2001)


BindingDB Entry DOI: 10.7270/Q2J964W8
More data for this
Ligand-Target Pair
Acetylcholinesterase (AChE)


(Torpedo marmorata (Marbled electric ray))
BDBM50119793
PNG
(1,1'-(dodecane-1,12-diyl)dipyridinium bromide | 1,...)
Show SMILES C(CCCCCC[n+]1ccccc1)CCCCC[n+]1ccccc1
Show InChI InChI=1S/C22H34N2/c1(3-5-7-11-17-23-19-13-9-14-20-23)2-4-6-8-12-18-24-21-15-10-16-22-24/h9-10,13-16,19-22H,1-8,11-12,17-18H2/q+2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 16n/an/an/an/a4.025



Université Louis Pasteur



Assay Description
The inhibitory activity of the equilibrated mixtures was determined. The activity of AChE was monitored by following the linear change in absorbance...


Chembiochem 2: 438-44 (2001)


BindingDB Entry DOI: 10.7270/Q2J964W8
More data for this
Ligand-Target Pair
Acetylcholinesterase (AChE)


(Torpedo marmorata (Marbled electric ray))
BDBM50119779
PNG
(1,1'-(decane-1,10-diyl)dipyridinium iodide | 1,10-...)
Show SMILES C(CCCCC[n+]1ccccc1)CCCC[n+]1ccccc1
Show InChI InChI=1S/C20H30N2/c1(3-5-9-15-21-17-11-7-12-18-21)2-4-6-10-16-22-19-13-8-14-20-22/h7-8,11-14,17-20H,1-6,9-10,15-16H2/q+2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 25.8n/an/an/an/a4.025



Université Louis Pasteur



Assay Description
The inhibitory activity of the equilibrated mixtures was determined. The activity of AChE was monitored by following the linear change in absorbance...


Chembiochem 2: 438-44 (2001)


BindingDB Entry DOI: 10.7270/Q2J964W8
More data for this
Ligand-Target Pair
Acetylcholinesterase (AChE)


(Torpedo marmorata (Marbled electric ray))
BDBM50060533
PNG
(1,12-Bis(trimethyl ammonium)dodecane dibromide | 1...)
Show SMILES C[N+](C)(C)CCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C18H42N2/c1-19(2,3)17-15-13-11-9-7-8-10-12-14-16-18-20(4,5)6/h7-18H2,1-6H3/q+2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 93.2n/an/an/an/a4.025



Université Louis Pasteur



Assay Description
The inhibitory activity of the equilibrated mixtures was determined. The activity of AChE was monitored by following the linear change in absorbance...


Chembiochem 2: 438-44 (2001)


BindingDB Entry DOI: 10.7270/Q2J964W8
More data for this
Ligand-Target Pair
Acetylcholinesterase (AChE)


(Torpedo marmorata (Marbled electric ray))
BDBM50060582
PNG
(1,10-Bis(trimethyl ammonium)decane dibromide | 1,1...)
Show SMILES C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C16H38N2/c1-17(2,3)15-13-11-9-7-8-10-12-14-16-18(4,5)6/h7-16H2,1-6H3/q+2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
PC cid
PC sid
PDB
UniChem
PDB
PubMed
n/an/a 1.06E+3n/an/an/an/a4.025



Université Louis Pasteur



Assay Description
The inhibitory activity of the equilibrated mixtures was determined. The activity of AChE was monitored by following the linear change in absorbance...


Chembiochem 2: 438-44 (2001)


BindingDB Entry DOI: 10.7270/Q2J964W8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
HPr kinase


(Bacillus subtilis)
BDBM50137122
PNG
((3-Benzyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-...)
Show SMILES N=c1n(CC(=O)N\N=C\c2ccc(\C=N\NC(=O)Cn3c4ccccc4n(Cc4ccccc4)c3=N)cc2)c2ccccc2n1Cc1ccccc1
Show InChI InChI=1S/C40H36N10O2/c41-39-47(25-31-11-3-1-4-12-31)33-15-7-9-17-35(33)49(39)27-37(51)45-43-23-29-19-21-30(22-20-29)24-44-46-38(52)28-50-36-18-10-8-16-34(36)48(40(50)42)26-32-13-5-2-6-14-32/h1-24,41-42H,25-28H2,(H,45,51)(H,46,52)/b41-39?,42-40?,43-23+,44-24+
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.70E+4n/an/an/an/a7.0n/a



ISIS-Universit£ Louis Pasteur

Curated by ChEMBL


Assay Description
Inhibition of bifunctional enzyme HPr kinase/phosphatase from Bacillus subtilis at pH 7.0 and hill coefficient of 1.4


J Med Chem 46: 5803-11 (2003)


Article DOI: 10.1021/jm030917j
BindingDB Entry DOI: 10.7270/Q2Z038WD
More data for this
Ligand-Target Pair
HPr kinase


(Bacillus subtilis)
BDBM50137122
PNG
((3-Benzyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-...)
Show SMILES N=c1n(CC(=O)N\N=C\c2ccc(\C=N\NC(=O)Cn3c4ccccc4n(Cc4ccccc4)c3=N)cc2)c2ccccc2n1Cc1ccccc1
Show InChI InChI=1S/C40H36N10O2/c41-39-47(25-31-11-3-1-4-12-31)33-15-7-9-17-35(33)49(39)27-37(51)45-43-23-29-19-21-30(22-20-29)24-44-46-38(52)28-50-36-18-10-8-16-34(36)48(40(50)42)26-32-13-5-2-6-14-32/h1-24,41-42H,25-28H2,(H,45,51)(H,46,52)/b41-39?,42-40?,43-23+,44-24+
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80E+4n/an/an/an/a8.0n/a



ISIS-Universit£ Louis Pasteur

Curated by ChEMBL


Assay Description
Inhibition of bifunctional enzyme HPr kinase/phosphatase from Bacillus subtilis at pH 8.0 and hill coefficient of 2.9


J Med Chem 46: 5803-11 (2003)


Article DOI: 10.1021/jm030917j
BindingDB Entry DOI: 10.7270/Q2Z038WD
More data for this
Ligand-Target Pair