BDBM50322845 3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-4-yl)-1H-purine-2,6(3H,7H)-dione::8-(1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-purine-2,6(3H,7H)-dione::CHEMBL260975

SMILES: CCCn1c(=O)n(C)c2nc([nH]c2c1=O)-c1cnn(Cc2cccc(c2)C(F)(F)F)c1

InChI Key: InChIKey=BWVLVKYENDCAHC-UHFFFAOYSA-N

Data: 8 KI

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 8 hits for monomerid = 50322845   

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
Adenosine receptor A2b (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A2b (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A3 (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		408	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		408	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A1 (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		441	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
Adenosine receptor A1 (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		441	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A2a (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		450	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
Adenosine receptor A2a (Human)	BDBM50322845 (3-methyl-1-propyl-8-(1-(3-(trifluoromethyl)benzyl)...) Show SMILES Show InChI	GoogleScholar	UniChem		450	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