BDBM92962 ThDP

SMILES Cc1c(CCOP(O)(=O)OP(O)(O)=O)sc[n+]1Cc1cnc(C)nc1N

InChI Key InChIKey=AYEKOFBPNLCAJY-UHFFFAOYSA-O

Data  4 KI  3 Kd

PDB links: 283 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 92962   

TargetThiamine-binding periplasmic protein(Escherichia coli (strain K12))
Cornell University

LigandPNGBDBM92962(ThDP)
Affinity DataKd:  7.40nMAssay Description:the kd for ThOH, ThMP and ThDP were determined using titration experiments in which the change in the intrinsic protein fluorescence was monitored as...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
Target1-deoxy-D-xylulose-5-phosphate synthase(Deinococcus radiodurans (strain ATCC 13939 / DSM 2...)
University of Groningen

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKd:  114nMAssay Description:Binding affinity to Deinococcus radiodurans DXSMore data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
Target1-deoxy-D-xylulose-5-phosphate synthase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
University of Groningen

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKd:  3.10E+3nMAssay Description:Binding affinity to Mycobacterium tuberculosis DXSMore data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetAcetylcholinesterase(Electric eel)
TBA

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKi:  5.84E+7nMpH: 8.25Assay Description:Noncompetitive inhibition of electric eel AChE using acetylthiocholine chloride as substrate at pH 8.25 by Michaelis-Menten plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAcetylcholinesterase(Electric eel)
TBA

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKi:  1.42E+7nMpH: 8.25Assay Description:Competitive inhibition of electric eel AChE using acetylthiocholine chloride as substrate at pH 8.25 by Michaelis-Menten plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAcetylcholinesterase(Electric eel)
TBA

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKi:  1.46E+7nMpH: 7.0Assay Description:Competitive inhibition of electric eel AChE using acetylthiocholine chloride as substrate at pH 7 by Michaelis-Menten plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAcetylcholinesterase(Electric eel)
TBA

Curated by ChEMBL
LigandPNGBDBM92962(ThDP)
Affinity DataKi:  6.70E+6nMpH: 7.0Assay Description:Noncompetitive inhibition of electric eel AChE using acetylthiocholine chloride as substrate at pH 7 by Michaelis-Menten plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed