BDBM50086170 (4-Cyano-phenyl)-carbamic acid 4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenyl ester::CHEMBL1628266::CHEMBL273807::N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide::N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide(MRS-1754)::N-(4-cyanophenyl)-2-(4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy)acetamide

SMILES: CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1

InChI Key: InChIKey=AJBBEYXFRYFVNM-UHFFFAOYSA-N

Data: 63 KI  1 Kd  2 EC50

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 66 hits for monomerid = 50086170   

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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a
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Adenosine receptor A1/A2a/A2b/A3 (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	6.76E+4	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A2b (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.13	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A1 (Mouse)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.5	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 A2b (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.90	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 A2b (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.97	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 A2b (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.97	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 A2b (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.97	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		1.97	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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 A2a (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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 (Mouse)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		3.10	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 (Mouse)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		3.39	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		10.4	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
Adenosine receptor A2b (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		12.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		12.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		13	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		16.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		16.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		16.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		16.8	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 (Rat)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		17	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		210	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		>260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A3 (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		>290	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		400	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		403	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		407	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		500	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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 A2a (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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 A2a (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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 A2a (Human)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		503	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)	BDBM50086170 (CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...) Show SMILES Show InChI	GoogleScholar	UniChem		513	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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