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BDBM92961 ThMP

SMILES: Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)O

InChI Key: InChIKey=HZSAJDVWZRBGIF-UHFFFAOYSA-O

Data: 4 KI 1 Kd

PDB links: 11 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 92961
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Thiamine-binding periplasmic protein (Escherichia coli (strain K12))	BDBM92961 (ThMP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Electric eel)	BDBM92961 (ThMP) Show SMILES Show InChI	GoogleScholar	UniChem		5.90E+6	n/a	n/a	n/a	n/a	n/a	n/a	8.25	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Electric eel)	BDBM92961 (ThMP) Show SMILES Show InChI	GoogleScholar	UniChem		1.12E+7	n/a	n/a	n/a	n/a	n/a	n/a	8.25	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Electric eel)	BDBM92961 (ThMP) Show SMILES Show InChI	GoogleScholar	UniChem		3.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Electric eel)	BDBM92961 (ThMP) Show SMILES Show InChI	GoogleScholar	UniChem		9.30E+6	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair