BDBM50128063 Allyl-{6-[3-(4-bromo-phenyl)-benzo[d]isothiazol-6-yloxy]-hexyl}-methyl-amine::CHEMBL112210::CHEMBL67133::N-(6-{[3-(4-BROMOPHENYL)-1,2-BENZISOTHIAZOL-6-YL]OXY}HEXYL)-N-METHYLPROP-2-EN-1-AMINE::N-allyl-6-(3-(4-bromophenyl)benzo[d]isothiazol-6-yloxy)-N-methylhexan-1-aminium

SMILES: C[N@@](CCCCCCOc1ccc2c(c1)snc2c3ccc(cc3)Br)CC=C

InChI Key: InChIKey=UCIDPJLYUKNYFZ-UHFFFAOYSA-N

Data: 9 IC50

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 9 hits for monomerid = 50128063   

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
Squalene--hopene cyclase (Alicyclobacillus acidocaldarius)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	306	n/a	n/a	n/a	n/a	n/a	n/a
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Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
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Lanosterol synthase ERG7 (Baker's yeast)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
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Cycloartenol synthase (Mouse-ear cress)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.88	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128063 (CHEMBL67133 | CHEMBL112210 | Allyl-{6-[3-(4-bromo-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair