BDBM50229885 CHEMBL260331::CHEMBL506685::N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-1-methyl-1H-pyrazol-3-yloxy)acetamide::N-Benzo[1,3]dioxol-5-yl-2-[5-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-1-methyl-1H-pyrazol-3-yloxy]-acetamide

SMILES: CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)Nc2ccc3OCOc3c2)nn1C

InChI Key: InChIKey=DBWQRFKXNBVPGA-UHFFFAOYSA-N

Data: 30 KI  2 IC50  2 Kd

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 34 hits for monomerid = 50229885   

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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.65	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	38	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	38	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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 A2b (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		5.5	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		200	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		248	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)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A2a (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A2a (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A2a (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A2a (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A2a (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+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
Adenosine receptor A3 (Human)	BDBM50229885 (N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(2,6-dioxo-1,3-d...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+3	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