BDBM50149891 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(OXY)]TRIS[N,N,N-TRIETHYLETHANAMINIUM]::CHEMBL360055::GALLAMINE

SMILES: CC[N+](CC)(CC)CCOc1cccc(c1OCC[N+](CC)(CC)CC)OCC[N+](CC)(CC)CC

InChI Key: InChIKey=OZLPUNFFCJDMJD-UHFFFAOYSA-N

Data: 7 KI  4 IC50  3 EC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50149891   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Muscarinic acetylcholine receptor M2 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	776	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.11E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electric eel)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.15E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Pig)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	130	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bovine)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.76E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.74E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		468	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		1.73E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Rat)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		2.61E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		3.72E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		8.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Pacific electric ray)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Human)	BDBM50149891 (CHEMBL360055 | 2,2',2''-[1,2,3-BENZENE-TRIYLTRIS(O...) Show SMILES Show InChI	GoogleScholar	UniChem		3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair