BDBM50760 3-Methyl-8-phenethylsulfanyl-7-propyl-3,7-dihydro-purine-2,6-dione::3-methyl-8-(2-phenylethylsulfanyl)-7-propyl-purine-2,6-dione::3-methyl-8-(2-phenylethylsulfanyl)-7-propylpurine-2,6-dione::3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-dione::3-methyl-8-(phenethylthio)-7-propyl-xanthine::MLS000030711::SMR000009144::cid_650170

SMILES: CCCn1c(SCCc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12

InChI Key: InChIKey=SGNIXJCUFHSJEL-UHFFFAOYSA-N

Data: 7 IC50

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 7 hits for monomerid = 50760   

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
Glycoprotein 42 (HHV-4)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
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G-protein coupled receptor 35 (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Nucleotide-binding oligomerization domain-containing protein 2 (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tumor necrosis factor (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2 (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tumor necrosis factor (Human)	BDBM50760 (3-methyl-8-(2-phenylethylthio)-7-propylpurine-2,6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair