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2 similar compounds to monomer 50383005

Wt: 276.2
BDBM50083917
Wt: 352.3
BDBM50102284

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50083917,50102284   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptors; A1 & A2a


(Homo sapiens (human))
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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PubMed
62n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human A1 adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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63n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CHA from adenosine A1 receptors was determined in bovine cortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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93.1n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Intrinsic activity towards Adenosine A1 receptor as displacement of [3H]DPCPX from bovine cortical membranes without GTP


Citation and Details
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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119n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Intrinsic activity towards Adenosine A1 receptor as displacement of [3H]DPCPX from bovine cortical membranes with 1 mM GTP


Citation and Details
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
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184n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Intrinsic activity towards Adenosine A1 receptor as displacement of [3H]DPCPX from bovine cortical membranes with 1 mM GTP


Citation and Details
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
PDB

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240n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Intrinsic activity towards Adenosine A1 receptor as displacement of [3H]DPCPX from bovine cortical membranes without GTP


Citation and Details
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(BOVINE)
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
PDB

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274n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CHA from adenosine A1 receptors was determined in bovine cortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Adenosine receptors; A1 & A2a


(Homo sapiens (human))
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
PDB

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PubMed
299n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human A1 adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (human))
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human A3 adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (human))
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human A3 adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptors; A1 & A2a


(Homo sapiens (human))
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
PDB
MMDB

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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptors; A1 & A2a


(Homo sapiens (human))
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
PDB
MMDB

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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human A2A adenosine receptor expressed in CHO cell membrane


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))
BDBM50102284
PNG
(10-Benzyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES O=c1c(nnc2n(Cc3ccccc3)c3ccccc3n12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O/c27-21-20(17-11-5-2-6-12-17)23-24-22-25(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)26(21)22/h1-14H,15H2
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n/an/a 54.3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity at human A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated cAMP accumulation


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))
BDBM50083917
PNG
(10-methyl-3-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,...)
Show SMILES Cn1c2ccccc2n2c1nnc(-c1ccccc1)c2=O
Show InChI InChI=1S/C16H12N4O/c1-19-12-9-5-6-10-13(12)20-15(21)14(17-18-16(19)20)11-7-3-2-4-8-11/h2-10H,1H3
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n/an/a 58n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity at human A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated cAMP accumulation


J Med Chem 55: 1490-9 (2012)

More data for this
Ligand-Target Pair