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PubMed code 18201066

Compile data set for download or QSAR
Found 48 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27391
PNG
(5,13,17-triazatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES O=C1NCCc2[nH]c3c(ccc4cnccc34)c12
Show InChI InChI=1S/C14H11N3O/c18-14-12-10-2-1-8-7-15-5-3-9(8)13(10)17-11(12)4-6-16-14/h1-3,5,7,17H,4,6H2,(H,16,18)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27413
PNG
(2-(2-aminopyrimidin-4-yl)-1-(2-fluoroethyl)-1H,4H,...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1CCF
Show InChI InChI=1S/C13H14FN5O/c14-3-6-19-10-2-5-16-12(20)8(10)7-11(19)9-1-4-17-13(15)18-9/h1,4,7H,2-3,5-6H2,(H,16,20)(H2,15,17,18)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27412
PNG
(2-(2-aminopyrimidin-4-yl)-1-(cyclopropylmethyl)-1H...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1CC1CC1
Show InChI InChI=1S/C15H17N5O/c16-15-18-5-3-11(19-15)13-7-10-12(4-6-17-14(10)21)20(13)8-9-1-2-9/h3,5,7,9H,1-2,4,6,8H2,(H,17,21)(H2,16,18,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27390
PNG
(2-(2-amino-5-bromopyrimidin-4-yl)-1H,4H,5H,6H,7H-p...)
Show SMILES Nc1ncc(Br)c(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C11H10BrN5O/c12-6-4-15-11(13)17-9(6)8-3-5-7(16-8)1-2-14-10(5)18/h3-4,16H,1-2H2,(H,14,18)(H2,13,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27406
PNG
(2-(2-aminopyrimidin-4-yl)-1-(2,2,2-trifluoroethyl)...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1CC(F)(F)F
Show InChI InChI=1S/C13H12F3N5O/c14-13(15,16)6-21-9-2-4-18-11(22)7(9)5-10(21)8-1-3-19-12(17)20-8/h1,3,5H,2,4,6H2,(H,18,22)(H2,17,19,20)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27351
PNG
(2-(2-aminopyrimidin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C11H11N5O/c12-11-14-4-2-8(16-11)9-5-6-7(15-9)1-3-13-10(6)17/h2,4-5,15H,1,3H2,(H,13,17)(H2,12,14,16)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27421
PNG
(2-[2-(phenylamino)pyrimidin-4-yl]-1H,4H,5H,6H,7H-p...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C17H15N5O/c23-16-12-10-15(21-13(12)6-8-18-16)14-7-9-19-17(22-14)20-11-4-2-1-3-5-11/h1-5,7,9-10,21H,6,8H2,(H,18,23)(H,19,20,22)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27404
PNG
(2-(2-aminopyrimidin-4-yl)-1-ethyl-1H,4H,5H,6H,7H-p...)
Show SMILES CCn1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C13H15N5O/c1-2-18-10-4-6-15-12(19)8(10)7-11(18)9-3-5-16-13(14)17-9/h3,5,7H,2,4,6H2,1H3,(H,15,19)(H2,14,16,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27382
PNG
(2-(3-fluoropyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,...)
Show SMILES Fc1cnccc1-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C12H10FN3O/c13-9-6-14-3-1-7(9)11-5-8-10(16-11)2-4-15-12(8)17/h1,3,5-6,16H,2,4H2,(H,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27344
PNG
(2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyri...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccncc1
Show InChI InChI=1S/C12H11N3O/c16-12-9-7-11(8-1-4-13-5-2-8)15-10(9)3-6-14-12/h1-2,4-5,7,15H,3,6H2,(H,14,16)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27407
PNG
(2-(2-aminopyrimidin-4-yl)-1-propyl-1H,4H,5H,6H,7H-...)
Show SMILES CCCn1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C14H17N5O/c1-2-7-19-11-4-6-16-13(20)9(11)8-12(19)10-3-5-17-14(15)18-10/h3,5,8H,2,4,6-7H2,1H3,(H,16,20)(H2,15,17,18)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27411
PNG
(2-(2-aminopyrimidin-4-yl)-1-(2-methylpropyl)-1H,4H...)
Show SMILES CC(C)Cn1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C15H19N5O/c1-9(2)8-20-12-4-6-17-14(21)10(12)7-13(20)11-3-5-18-15(16)19-11/h3,5,7,9H,4,6,8H2,1-2H3,(H,17,21)(H2,16,18,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27409
PNG
(2-(2-aminopyrimidin-4-yl)-1-cyclobutyl-1H,4H,5H,6H...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1C1CCC1
Show InChI InChI=1S/C15H17N5O/c16-15-18-6-4-11(19-15)13-8-10-12(5-7-17-14(10)21)20(13)9-2-1-3-9/h4,6,8-9H,1-3,5,7H2,(H,17,21)(H2,16,18,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27384
PNG
(2-{1H-pyrrolo[2,3-b]pyridin-4-yl}-1H,4H,5H,6H,7H-p...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H12N4O/c19-14-10-7-12(18-11(10)3-6-17-14)8-1-4-15-13-9(8)2-5-16-13/h1-2,4-5,7,18H,3,6H2,(H,15,16)(H,17,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27383
PNG
(2-(pyrimidin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]py...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccncn1
Show InChI InChI=1S/C11H10N4O/c16-11-7-5-10(9-1-3-12-6-14-9)15-8(7)2-4-13-11/h1,3,5-6,15H,2,4H2,(H,13,16)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27410
PNG
(2-(2-aminopyrimidin-4-yl)-1-butyl-1H,4H,5H,6H,7H-p...)
Show SMILES CCCCn1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C15H19N5O/c1-2-3-8-20-12-5-7-17-14(21)10(12)9-13(20)11-4-6-18-15(16)19-11/h4,6,9H,2-3,5,7-8H2,1H3,(H,17,21)(H2,16,18,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27397
PNG
(2-(pyridin-4-yl)-1H,4H,5H,6H-pyrrolo[2,3-c]pyrrol-...)
Show SMILES O=C1NCc2[nH]c(cc12)-c1ccncc1
Show InChI InChI=1S/C11H9N3O/c15-11-8-5-9(14-10(8)6-13-11)7-1-3-12-4-2-7/h1-5,14H,6H2,(H,13,15)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27389
PNG
(2-(2-aminopyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2...)
Show SMILES Nc1cc(ccn1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C12H12N4O/c13-11-5-7(1-3-14-11)10-6-8-9(16-10)2-4-15-12(8)17/h1,3,5-6,16H,2,4H2,(H2,13,14)(H,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27408
PNG
(2-(2-aminopyrimidin-4-yl)-1-(propan-2-yl)-1H,4H,5H...)
Show SMILES CC(C)n1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C14H17N5O/c1-8(2)19-11-4-6-16-13(20)9(11)7-12(19)10-3-5-17-14(15)18-10/h3,5,7-8H,4,6H2,1-2H3,(H,16,20)(H2,15,17,18)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27393
PNG
(3-methyl-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3...)
Show SMILES Cc1c([nH]c2CCNC(=O)c12)-c1ccncc1
Show InChI InChI=1S/C13H13N3O/c1-8-11-10(4-7-15-13(11)17)16-12(8)9-2-5-14-6-3-9/h2-3,5-6,16H,4,7H2,1H3,(H,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27414
PNG
(2-(2-aminopyrimidin-4-yl)-1-(4,4,4-trifluorobutyl)...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1CCCC(F)(F)F
Show InChI InChI=1S/C15H16F3N5O/c16-15(17,18)4-1-7-23-11-3-6-20-13(24)9(11)8-12(23)10-2-5-21-14(19)22-10/h2,5,8H,1,3-4,6-7H2,(H,20,24)(H2,19,21,22)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27400
PNG
(1-ethyl-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,...)
Show SMILES CCn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C14H15N3O/c1-2-17-12-5-8-16-14(18)11(12)9-13(17)10-3-6-15-7-4-10/h3-4,6-7,9H,2,5,8H2,1H3,(H,16,18)
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Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27403
PNG
(2-(2-aminopyrimidin-4-yl)-1-methyl-1H,4H,5H,6H,7H-...)
Show SMILES Cn1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C12H13N5O/c1-17-9-3-5-14-11(18)7(9)6-10(17)8-2-4-15-12(13)16-8/h2,4,6H,3,5H2,1H3,(H,14,18)(H2,13,15,16)
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n/an/a 88n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27418
PNG
(2-(2-aminopyrimidin-4-yl)-1-(1-methylpiperidin-4-y...)
Show SMILES CN1CCC(CC1)n1c2CCNC(=O)c2cc1-c1ccnc(N)n1
Show InChI InChI=1S/C17H22N6O/c1-22-8-4-11(5-9-22)23-14-3-7-19-16(24)12(14)10-15(23)13-2-6-20-17(18)21-13/h2,6,10-11H,3-5,7-9H2,1H3,(H,19,24)(H2,18,20,21)
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Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27405
PNG
(2-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-1H,4H...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1CCO
Show InChI InChI=1S/C13H15N5O2/c14-13-16-3-1-9(17-13)11-7-8-10(18(11)5-6-19)2-4-15-12(8)20/h1,3,7,19H,2,4-6H2,(H,15,20)(H2,14,16,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27388
PNG
(2-(2-chloropyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,...)
Show SMILES Clc1cc(ccn1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C12H10ClN3O/c13-11-5-7(1-3-14-11)10-6-8-9(16-10)2-4-15-12(8)17/h1,3,5-6,16H,2,4H2,(H,15,17)
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n/an/a 147n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27398
PNG
(2-(pyridin-4-yl)-1H,4H,5H,6H,7H,8H-pyrrolo[3,2-c]a...)
Show SMILES O=C1NCCCc2[nH]c(cc12)-c1ccncc1
Show InChI InChI=1S/C13H13N3O/c17-13-10-8-12(9-3-6-14-7-4-9)16-11(10)2-1-5-15-13/h3-4,6-8,16H,1-2,5H2,(H,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27402
PNG
(2-(pyridin-4-yl)-1-(2,2,2-trifluoroethyl)-1H,4H,5H...)
Show SMILES FC(F)(F)Cn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C14H12F3N3O/c15-14(16,17)8-20-11-3-6-19-13(21)10(11)7-12(20)9-1-4-18-5-2-9/h1-2,4-5,7H,3,6,8H2,(H,19,21)
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n/an/a 160n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27385
PNG
(2-(9H-purin-6-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyr...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ncnc2nc[nH]c12
Show InChI InChI=1S/C12H10N6O/c19-12-6-3-8(18-7(6)1-2-13-12)9-10-11(16-4-14-9)17-5-15-10/h3-5,18H,1-2H2,(H,13,19)(H,14,15,16,17)
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Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27396
PNG
(2-(pyridin-4-yl)-4H,5H,6H,7H-furo[3,2-c]pyridin-4-...)
Show SMILES O=C1NCCc2oc(cc12)-c1ccncc1
Show InChI InChI=1S/C12H10N2O2/c15-12-9-7-11(8-1-4-13-5-2-8)16-10(9)3-6-14-12/h1-2,4-5,7H,3,6H2,(H,14,15)
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Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27395
PNG
(2-(pyridin-4-yl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazi...)
Show SMILES O=C1NCCn2nc(cc12)-c1ccncc1
Show InChI InChI=1S/C11H10N4O/c16-11-10-7-9(8-1-3-12-4-2-8)14-15(10)6-5-13-11/h1-4,7H,5-6H2,(H,13,16)
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n/an/a 210n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27422
PNG
(2-[2-(benzylamino)pyrimidin-4-yl]-1H,4H,5H,6H,7H-p...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccnc(NCc2ccccc2)n1
Show InChI InChI=1S/C18H17N5O/c24-17-13-10-16(22-14(13)6-8-19-17)15-7-9-20-18(23-15)21-11-12-4-2-1-3-5-12/h1-5,7,9-10,22H,6,8,11H2,(H,19,24)(H,20,21,23)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27419
PNG
(2-[2-(propylamino)pyrimidin-4-yl]-1H,4H,5H,6H,7H-p...)
Show SMILES CCCNc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C14H17N5O/c1-2-5-16-14-17-7-4-11(19-14)12-8-9-10(18-12)3-6-15-13(9)20/h4,7-8,18H,2-3,5-6H2,1H3,(H,15,20)(H,16,17,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27426
PNG
(N-(4-{4-oxo-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-2...)
Show SMILES O=C(Nc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1)c1ccccc1
Show InChI InChI=1S/C18H15N5O2/c24-16(11-4-2-1-3-5-11)23-18-20-9-7-14(22-18)15-10-12-13(21-15)6-8-19-17(12)25/h1-5,7,9-10,21H,6,8H2,(H,19,25)(H,20,22,23,24)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27417
PNG
(2-(2-aminopyrimidin-4-yl)-1-benzyl-1H,4H,5H,6H,7H-...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1Cc1ccccc1
Show InChI InChI=1S/C18H17N5O/c19-18-21-8-6-14(22-18)16-10-13-15(7-9-20-17(13)24)23(16)11-12-4-2-1-3-5-12/h1-6,8,10H,7,9,11H2,(H,20,24)(H2,19,21,22)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27424
PNG
(N-(4-{4-oxo-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-2...)
Show SMILES CC(=O)Nc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-7(19)16-13-15-5-3-10(18-13)11-6-8-9(17-11)2-4-14-12(8)20/h3,5-6,17H,2,4H2,1H3,(H,14,20)(H,15,16,18,19)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27394
PNG
(1-methyl-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3...)
Show SMILES Cn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C13H13N3O/c1-16-11-4-7-15-13(17)10(11)8-12(16)9-2-5-14-6-3-9/h2-3,5-6,8H,4,7H2,1H3,(H,15,17)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27420
PNG
(2-{2-[(2-methylpropyl)amino]pyrimidin-4-yl}-1H,4H,...)
Show SMILES CC(C)CNc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C15H19N5O/c1-9(2)8-18-15-17-6-4-12(20-15)13-7-10-11(19-13)3-5-16-14(10)21/h4,6-7,9,19H,3,5,8H2,1-2H3,(H,16,21)(H,17,18,20)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27423
PNG
(2-{2-[(cyclohexylmethyl)amino]pyrimidin-4-yl}-1H,4...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccnc(NCC2CCCCC2)n1
Show InChI InChI=1S/C18H23N5O/c24-17-13-10-16(22-14(13)6-8-19-17)15-7-9-20-18(23-15)21-11-12-4-2-1-3-5-12/h7,9-10,12,22H,1-6,8,11H2,(H,19,24)(H,20,21,23)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27399
PNG
(4-oxo-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-...)
Show SMILES O=CN1CCc2[nH]c(cc2C1=O)-c1ccncc1
Show InChI InChI=1S/C13H11N3O2/c17-8-16-6-3-11-10(13(16)18)7-12(15-11)9-1-4-14-5-2-9/h1-2,4-5,7-8,15H,3,6H2
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27425
PNG
(2-methyl-N-(4-{4-oxo-1H,4H,5H,6H,7H-pyrrolo[3,2-c]...)
Show SMILES CC(C)C(=O)Nc1nccc(n1)-c1cc2c(CCNC2=O)[nH]1
Show InChI InChI=1S/C15H17N5O2/c1-8(2)13(21)20-15-17-6-4-11(19-15)12-7-9-10(18-12)3-5-16-14(9)22/h4,6-8,18H,3,5H2,1-2H3,(H,16,22)(H,17,19,20,21)
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Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27401
PNG
(1-(2-hydroxyethyl)-2-(pyridin-4-yl)-1H,4H,5H,6H,7H...)
Show SMILES OCCn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C14H15N3O2/c18-8-7-17-12-3-6-16-14(19)11(12)9-13(17)10-1-4-15-5-2-10/h1-2,4-5,9,18H,3,6-8H2,(H,16,19)
PDB

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n/an/a 3.30E+3n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27392
PNG
(3-(2-aminopyrimidin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3...)
Show SMILES Nc1nccc(n1)-c1c[nH]c2CCNC(=O)c12
Show InChI InChI=1S/C11H11N5O/c12-11-14-4-1-7(16-11)6-5-15-8-2-3-13-10(17)9(6)8/h1,4-5,15H,2-3H2,(H,13,17)(H2,12,14,16)
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n/an/a>5.00E+3n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27415
PNG
(2-(2-aminopyrimidin-4-yl)-1-cyclohexyl-1H,4H,5H,6H...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1C1CCCCC1
Show InChI InChI=1S/C17H21N5O/c18-17-20-8-6-13(21-17)15-10-12-14(7-9-19-16(12)23)22(15)11-4-2-1-3-5-11/h6,8,10-11H,1-5,7,9H2,(H,19,23)(H2,18,20,21)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27386
PNG
(2-phenyl-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-on...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccccc1
Show InChI InChI=1S/C13H12N2O/c16-13-10-8-12(9-4-2-1-3-5-9)15-11(10)6-7-14-13/h1-5,8,15H,6-7H2,(H,14,16)
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n/an/a>5.00E+3n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27387
PNG
(1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one | pyrro...)
Show SMILES O=C1NCCc2[nH]ccc12
Show InChI InChI=1S/C7H8N2O/c10-7-5-1-3-8-6(5)2-4-9-7/h1,3,8H,2,4H2,(H,9,10)
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n/an/a>5.00E+3n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27416
PNG
(2-(2-aminopyrimidin-4-yl)-1-phenyl-1H,4H,5H,6H,7H-...)
Show SMILES Nc1nccc(n1)-c1cc2c(CCNC2=O)n1-c1ccccc1
Show InChI InChI=1S/C17H15N5O/c18-17-20-8-6-13(21-17)15-10-12-14(7-9-19-16(12)23)22(15)11-4-2-1-3-5-11/h1-6,8,10H,7,9H2,(H,19,23)(H2,18,20,21)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27381
PNG
(2-(pyridin-3-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyri...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1cccnc1
Show InChI InChI=1S/C12H11N3O/c16-12-9-6-11(8-2-1-4-13-7-8)15-10(9)3-5-14-12/h1-2,4,6-7,15H,3,5H2,(H,14,16)
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n/an/a>5.00E+3n/an/an/an/a7.925



Nerviano Medical Sciences Srl



Assay Description
The potency of the compound toward kinase activity was determined using a Dowex resin-based assay. The substrate was phosphorylated by kinase in the ...


J Med Chem 51: 487-501 (2008)


Article DOI: 10.1021/jm700956r
BindingDB Entry DOI: 10.7270/Q247485B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%