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Compile Data Set for Download or QSAR

Found 85 hits of ic50 data for polymerid = 50001002,50002231   
Target
(Institution)
LigandTarget
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
Adenylate cyclase


(Homo sapiens)
BDBM50090529
PNG
(2-[1-(Naphthalene-1-sulfonyl)-1H-indol-6-yl]-octah...)
Show SMILES O=S(=O)(c1cccc2ccccc12)n1ccc2ccc(cc12)N1CCN2CCCC2C1
Show InChI InChI=1S/C25H25N3O2S/c29-31(30,25-9-3-6-19-5-1-2-8-23(19)25)28-14-12-20-10-11-21(17-24(20)28)27-16-15-26-13-4-7-22(26)18-27/h1-3,5-6,8-12,14,17,22H,4,7,13,15-16,18H2
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n/an/a 7.20n/an/an/an/an/an/a



NPS Allelix Corp.

Curated by ChEMBL


Assay Description
Antagonistic activity of the compound evaluated in adenylyl cyclase assay


Bioorg Med Chem Lett 10: 1719-21 (2000)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128187
PNG
((1R,3R)-3-(6-Amino-purin-9-yl)-cyclopentanecarboxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@@H](C1)C(=O)NO
Show InChI InChI=1S/C11H14N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h4-7,19H,1-3H2,(H,16,18)(H2,12,13,14)/t6-,7-/m0/s1
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n/an/a 200n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128192
PNG
((1S,3R)-2-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@@H](CC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a 400n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128210
PNG
((1R,3R)-2-[3-(6-Amino-purin-9-yl)-cyclopentyl]-N-h...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC(=O)NO)C1
Show InChI InChI=1S/C12H16N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m1/s1
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n/an/a 600n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128207
PNG
((1S,3S)-2-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](CC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 2.60E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase type V


(Rattus norvegicus)
BDBM50140057
PNG
(2-Hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetra...)
Show SMILES CC1OC(CC1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C10H13N5O2/c1-5-6(16)2-7(17-5)15-4-14-8-9(11)12-3-13-10(8)15/h3-7,16H,2H2,1H3,(H2,11,12,13)
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n/an/a 2.80E+3n/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of adenylate cyclase from rat brain


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128209
PNG
((1R,3S)-2-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@H](CC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m1/s1
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n/an/a 4.30E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128203
PNG
((1R,3S)-3-(6-Amino-purin-9-yl)-cyclopentanecarboxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@H](C1)C(=O)NO
Show InChI InChI=1S/C11H14N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h4-7,19H,1-3H2,(H,16,18)(H2,12,13,14)/t6-,7+/m1/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase type V


(Rattus norvegicus)
BDBM50370376
PNG
(CHEMBL1229920)
Show SMILES Nc1nc(F)nc2n(cnc12)[C@H]1C[C@H](O)[C@@H](CO)O1
Show InChI InChI=1S/C10H12FN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5+,6+/m0/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of adenylate cyclase from rat brain


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128199
PNG
((1S,3S)-4-(6-Amino-purin-9-yl)-cyclopent-2-enecarb...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@H](C=C1)C(=O)NO
Show InChI InChI=1S/C11H12N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h1-2,4-7,19H,3H2,(H,16,18)(H2,12,13,14)/t6-,7-/m0/s1
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n/an/a 4.90E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119826
PNG
(5-(6-Amino-purin-9-yl)-pentanoic acid hydroxyamide...)
Show SMILES Nc1ncnc2n(CCCCC(=O)NO)cnc12
Show InChI InChI=1S/C10H14N6O2/c11-9-8-10(13-5-12-9)16(6-14-8)4-2-1-3-7(17)15-18/h5-6,18H,1-4H2,(H,15,17)(H2,11,12,13)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119826
PNG
(5-(6-Amino-purin-9-yl)-pentanoic acid hydroxyamide...)
Show SMILES Nc1ncnc2n(CCCCC(=O)NO)cnc12
Show InChI InChI=1S/C10H14N6O2/c11-9-8-10(13-5-12-9)16(6-14-8)4-2-1-3-7(17)15-18/h5-6,18H,1-4H2,(H,15,17)(H2,11,12,13)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119826
PNG
(5-(6-Amino-purin-9-yl)-pentanoic acid hydroxyamide...)
Show SMILES Nc1ncnc2n(CCCCC(=O)NO)cnc12
Show InChI InChI=1S/C10H14N6O2/c11-9-8-10(13-5-12-9)16(6-14-8)4-2-1-3-7(17)15-18/h5-6,18H,1-4H2,(H,15,17)(H2,11,12,13)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119832
PNG
(4-(6-Amino-purin-9-yl)-N-hydroxy-butyramide | CHEM...)
Show SMILES Nc1ncnc2n(CCCC(=O)NO)cnc12
Show InChI InChI=1S/C9H12N6O2/c10-8-7-9(12-4-11-8)15(5-13-7)3-1-2-6(16)14-17/h4-5,17H,1-3H2,(H,14,16)(H2,10,11,12)
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n/an/a 7.90E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119832
PNG
(4-(6-Amino-purin-9-yl)-N-hydroxy-butyramide | CHEM...)
Show SMILES Nc1ncnc2n(CCCC(=O)NO)cnc12
Show InChI InChI=1S/C9H12N6O2/c10-8-7-9(12-4-11-8)15(5-13-7)3-1-2-6(16)14-17/h4-5,17H,1-3H2,(H,14,16)(H2,10,11,12)
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n/an/a 7.90E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119832
PNG
(4-(6-Amino-purin-9-yl)-N-hydroxy-butyramide | CHEM...)
Show SMILES Nc1ncnc2n(CCCC(=O)NO)cnc12
Show InChI InChI=1S/C9H12N6O2/c10-8-7-9(12-4-11-8)15(5-13-7)3-1-2-6(16)14-17/h4-5,17H,1-3H2,(H,14,16)(H2,10,11,12)
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n/an/a 7.90E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128188
PNG
((1S,3R)-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl]-...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@@H](CC(O)=O)C=C1
Show InChI InChI=1S/C12H13N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(3-8)4-9(18)19/h1-2,5-8H,3-4H2,(H,18,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a 8.20E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128206
PNG
((1S,3S)-2-[3-(6-Amino-purin-9-yl)-cyclopentyl]-N-h...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@H](CC(=O)NO)C1
Show InChI InChI=1S/C12H16N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a 9.40E+3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119858
PNG
(2-[(S)-3-((S)-6-Amino-purin-9-yl)-cyclopentyloxy]-...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](C1)OCC(=O)NO
Show InChI InChI=1S/C12H16N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 1.08E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128191
PNG
(2-[3-(6-Amino-purin-9-yl)-cyclopentyloxy]-N-hydrox...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@@H](C1)OCC(=O)NO
Show InChI InChI=1S/C12H16N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a 1.08E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119855
PNG
(2-{[(1S,4R)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@H](OCC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 1.36E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128205
PNG
(2-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyloxy]-N-h...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@@H](OCC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a 1.36E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase type V


(Rattus norvegicus)
BDBM50025883
PNG
((2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymet...)
Show SMILES Nc1ncnc2n(cnc12)C1CC(O)C(CO)O1
Show InChI InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)
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n/an/a 1.50E+4n/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of adenylate cyclase from rat brain


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119844
PNG
(2-{[2-(6-Amino-purin-9-yl)-ethyl]-methyl-amino}-N-...)
Show SMILES CN(CCn1cnc2c(N)ncnc12)CC(=O)NO
Show InChI InChI=1S/C10H15N7O2/c1-16(4-7(18)15-19)2-3-17-6-14-8-9(11)12-5-13-10(8)17/h5-6,19H,2-4H2,1H3,(H,15,18)(H2,11,12,13)
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n/an/a 1.53E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128204
PNG
((1R,3R)-2-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@H](CC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 1.63E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128202
PNG
((1R,3S)-2-[3-(6-Amino-purin-9-yl)-cyclopentyl]-N-h...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@@H](CC(=O)NO)C1
Show InChI InChI=1S/C12H16N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 2.51E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128195
PNG
((1R,3R)-[3-(6-Amino-purin-9-yl)-cyclopentyl]-aceti...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC(O)=O)C1
Show InChI InChI=1S/C12H15N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(3-8)4-9(18)19/h5-8H,1-4H2,(H,18,19)(H2,13,14,15)/t7-,8-/m1/s1
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n/an/a 2.88E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119842
PNG
(6-(6-Amino-purin-9-yl)-hexanoic acid hydroxyamide ...)
Show SMILES Nc1ncnc2n(CCCCCC(=O)NO)cnc12
Show InChI InChI=1S/C11H16N6O2/c12-10-9-11(14-6-13-10)17(7-15-9)5-3-1-2-4-8(18)16-19/h6-7,19H,1-5H2,(H,16,18)(H2,12,13,14)
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n/an/a 3.54E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119842
PNG
(6-(6-Amino-purin-9-yl)-hexanoic acid hydroxyamide ...)
Show SMILES Nc1ncnc2n(CCCCCC(=O)NO)cnc12
Show InChI InChI=1S/C11H16N6O2/c12-10-9-11(14-6-13-10)17(7-15-9)5-3-1-2-4-8(18)16-19/h6-7,19H,1-5H2,(H,16,18)(H2,12,13,14)
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n/an/a 3.54E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119842
PNG
(6-(6-Amino-purin-9-yl)-hexanoic acid hydroxyamide ...)
Show SMILES Nc1ncnc2n(CCCCCC(=O)NO)cnc12
Show InChI InChI=1S/C11H16N6O2/c12-10-9-11(14-6-13-10)17(7-15-9)5-3-1-2-4-8(18)16-19/h6-7,19H,1-5H2,(H,16,18)(H2,12,13,14)
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n/an/a 3.54E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128197
PNG
((1S,3R)-2-[3-(6-Amino-purin-9-yl)-cyclopentyl]-N-h...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@H](CC(=O)NO)C1
Show InChI InChI=1S/C12H16N6O2/c13-11-10-12(15-5-14-11)18(6-16-10)8-2-1-7(3-8)4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 5.50E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128201
PNG
((1S,3R)-3-(6-Amino-purin-9-yl)-cyclopentanecarboxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](C1)C(=O)NO
Show InChI InChI=1S/C11H14N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h4-7,19H,1-3H2,(H,16,18)(H2,12,13,14)/t6-,7+/m0/s1
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n/an/a>7.00E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119853
PNG
(2-{[(1S,4S)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@H](OCC(O)=O)C=C1
Show InChI InChI=1S/C12H13N5O3/c13-11-10-12(15-5-14-11)17(6-16-10)7-1-2-8(3-7)20-4-9(18)19/h1-2,5-8H,3-4H2,(H,18,19)(H2,13,14,15)/t7-,8-/m1/s1
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n/an/a 7.20E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128190
PNG
((1S,3S)-[4-(6-Amino-purin-9-yl)-cyclopent-2-enyl]-...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](CC(O)=O)C=C1
Show InChI InChI=1S/C12H13N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(3-8)4-9(18)19/h1-2,5-8H,3-4H2,(H,18,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 7.32E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128186
PNG
((1S,3S)-3-(6-Amino-purin-9-yl)-cyclopentanecarboxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@H](C1)C(=O)NO
Show InChI InChI=1S/C11H14N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h4-7,19H,1-3H2,(H,16,18)(H2,12,13,14)/t6-,7-/m1/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119860
PNG
(2-{[(1S,4R)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@H](OCC(O)=O)C=C1
Show InChI InChI=1S/C12H13N5O3/c13-11-10-12(15-5-14-11)17(6-16-10)7-1-2-8(3-7)20-4-9(18)19/h1-2,5-8H,3-4H2,(H,18,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119857
PNG
(CHEMBL108067 | [(S)-3-((S)-6-Amino-purin-9-yl)-cyc...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](C1)OCC(O)=O
Show InChI InChI=1S/C12H15N5O3/c13-11-10-12(15-5-14-11)17(6-16-10)7-1-2-8(3-7)20-4-9(18)19/h5-8H,1-4H2,(H,18,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 7.90E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119821
PNG
(2-[3-(6-Amino-purin-9-yl)-propoxy]-N-hydroxy-aceta...)
Show SMILES Nc1ncnc2n(CCCOCC(=O)NO)cnc12
Show InChI InChI=1S/C10H14N6O3/c11-9-8-10(13-5-12-9)16(6-14-8)2-1-3-19-4-7(17)15-18/h5-6,18H,1-4H2,(H,15,17)(H2,11,12,13)
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n/an/a 9.40E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119821
PNG
(2-[3-(6-Amino-purin-9-yl)-propoxy]-N-hydroxy-aceta...)
Show SMILES Nc1ncnc2n(CCCOCC(=O)NO)cnc12
Show InChI InChI=1S/C10H14N6O3/c11-9-8-10(13-5-12-9)16(6-14-8)2-1-3-19-4-7(17)15-18/h5-6,18H,1-4H2,(H,15,17)(H2,11,12,13)
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n/an/a 9.40E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119854
PNG
(2-{[(1R,4S)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](OCC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 9.60E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119861
PNG
(2-{[(1R,4S)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](OCC(O)=O)C=C1
Show InChI InChI=1S/C12H13N5O3/c13-11-10-12(15-5-14-11)17(6-16-10)7-1-2-8(3-7)20-4-9(18)19/h1-2,5-8H,3-4H2,(H,18,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 9.80E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128189
PNG
((1S,3S)-[3-(6-Amino-purin-9-yl)-cyclopentyl]-aceti...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@H](CC(O)=O)C1
Show InChI InChI=1S/C12H15N5O2/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(3-8)4-9(18)19/h5-8H,1-4H2,(H,18,19)(H2,13,14,15)/t7-,8-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128194
PNG
((1R,3R)-4-(6-Amino-purin-9-yl)-cyclopent-2-enecarb...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](C=C1)C(=O)NO
Show InChI InChI=1S/C11H12N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h1-2,4-7,19H,3H2,(H,16,18)(H2,12,13,14)/t6-,7-/m1/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase type V


(Rattus norvegicus)
BDBM50008363
PNG
(5-(6-Amino-2-fluoro-purin-9-yl)-2-hydroxymethyl-te...)
Show SMILES Nc1nc(F)nc2n(cnc12)C1CC(O)C(CO)O1
Show InChI InChI=1S/C10H12FN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of adenylate cyclase from rat brain


Citation and Details
More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119854
PNG
(2-{[(1R,4S)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1C[C@@H](OCC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 1.02E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119858
PNG
(2-[(S)-3-((S)-6-Amino-purin-9-yl)-cyclopentyloxy]-...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](C1)OCC(=O)NO
Show InChI InChI=1S/C12H16N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m1/s1
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n/an/a 1.09E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119851
PNG
(2-[(R)-3-((R)-6-Amino-purin-9-yl)-cyclopentyloxy]-...)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CC[C@H](C1)OCC(=O)NO
Show InChI InChI=1S/C12H16N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h5-8,20H,1-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 1.10E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119855
PNG
(2-{[(1S,4R)-4-(6-amino-9H-purin-9-yl)cyclopent-2-e...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@H](OCC(=O)NO)C=C1
Show InChI InChI=1S/C12H14N6O3/c13-11-10-12(15-5-14-11)18(6-16-10)7-1-2-8(3-7)21-4-9(19)17-20/h1-2,5-8,20H,3-4H2,(H,17,19)(H2,13,14,15)/t7-,8+/m0/s1
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n/an/a 1.16E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against Type V Adenyl Cyclase enzyme


Bioorg Med Chem Lett 12: 3089-92 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50119829
PNG
(CHEMBL104969 | [3-(6-Amino-purin-9-yl)-propoxy]-ac...)
Show SMILES Nc1ncnc2n(CCCOCC(O)=O)cnc12
Show InChI InChI=1S/C10H13N5O3/c11-9-8-10(13-5-12-9)15(6-14-8)2-1-3-18-4-7(16)17/h5-6H,1-4H2,(H,16,17)(H2,11,12,13)
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n/an/a 1.41E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human adenylate cyclase 5 expressed in HEK293 cells


Bioorg Med Chem Lett 12: 3085-8 (2002)

More data for this
Ligand-Target Pair
Adenylate cyclase


(Homo sapiens)
BDBM50128211
PNG
((1S,3R)-4-(6-Amino-purin-9-yl)-cyclopent-2-enecarb...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@@H](C=C1)C(=O)NO
Show InChI InChI=1S/C11H12N6O2/c12-9-8-10(14-4-13-9)17(5-15-8)7-2-1-6(3-7)11(18)16-19/h1-2,4-7,19H,3H2,(H,16,18)(H2,12,13,14)/t6-,7+/m1/s1
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n/an/a 1.88E+5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human adenylate cyclase 5 expressed in HEK293 cells.


Citation and Details
More data for this
Ligand-Target Pair
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