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PubMed code 21282054

Compile data set for download or QSAR
Found 178 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
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337321
PNG
(5-(1-(3-methylbenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Cc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C17H15N5/c1-12-3-2-4-13(7-12)10-22-11-17(20-21-22)14-5-6-16-15(8-14)9-18-19-16/h2-9,11H,10H2,1H3,(H,18,19)
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15n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337322
PNG
(5-(1-(2,3-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-1-2-11(16(13)18)8-23-9-15(21-22-23)10-4-5-14-12(6-10)7-19-20-14/h1-7,9H,8H2,(H,19,20)
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15n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337329
PNG
(5-(1-(2,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1ccc(Cl)c(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-2-3-14(18)12(6-13)8-23-9-16(21-22-23)10-1-4-15-11(5-10)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337329
PNG
(5-(1-(2,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1ccc(Cl)c(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-2-3-14(18)12(6-13)8-23-9-16(21-22-23)10-1-4-15-11(5-10)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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18n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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18n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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19n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337317
PNG
(5-(1-(3-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12ClN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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23n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337320
PNG
(5-(1-(3-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12FN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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26n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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26n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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28n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337323
PNG
(5-(1-(3,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-10(4-14(18)6-13)8-23-9-16(21-22-23)11-1-2-15-12(5-11)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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28n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337317
PNG
(5-(1-(3-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12ClN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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39n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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39n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337323
PNG
(5-(1-(3,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-10(4-14(18)6-13)8-23-9-16(21-22-23)11-1-2-15-12(5-11)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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41n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337320
PNG
(5-(1-(3-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12FN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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42n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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44n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337316
PNG
(5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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45n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337322
PNG
(5-(1-(2,3-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-1-2-11(16(13)18)8-23-9-15(21-22-23)10-4-5-14-12(6-10)7-19-20-14/h1-7,9H,8H2,(H,19,20)
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48n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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62n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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64n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337322
PNG
(5-(1-(2,3-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-1-2-11(16(13)18)8-23-9-15(21-22-23)10-4-5-14-12(6-10)7-19-20-14/h1-7,9H,8H2,(H,19,20)
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66n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337318
PNG
(5-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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68n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337330
PNG
(5-(1-(4-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12FN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337321
PNG
(5-(1-(3-methylbenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Cc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C17H15N5/c1-12-3-2-4-13(7-12)10-22-11-17(20-21-22)14-5-6-16-15(8-14)9-18-19-16/h2-9,11H,10H2,1H3,(H,18,19)
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70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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73n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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91n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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91n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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97n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337316
PNG
(5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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97n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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100n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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108n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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113n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337317
PNG
(5-(1-(3-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12ClN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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160n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337320
PNG
(5-(1-(3-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12FN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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180n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337318
PNG
(5-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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186n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337318
PNG
(5-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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197n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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209n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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230n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337323
PNG
(5-(1-(3,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-10(4-14(18)6-13)8-23-9-16(21-22-23)11-1-2-15-12(5-11)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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240n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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252n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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265n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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281n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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284n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337330
PNG
(5-(1-(4-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12FN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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285n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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285n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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315n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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323n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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351n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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356n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337321
PNG
(5-(1-(3-methylbenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Cc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C17H15N5/c1-12-3-2-4-13(7-12)10-22-11-17(20-21-22)14-5-6-16-15(8-14)9-18-19-16/h2-9,11H,10H2,1H3,(H,18,19)
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375n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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402n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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446n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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448n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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450n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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482n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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493n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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524n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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528n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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542n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337316
PNG
(5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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553n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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572n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Rho-associated protein kinase


(Homo sapiens (Human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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635n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Rock2 after 1 hr using biotinylated longS peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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644n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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756n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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791n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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891n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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898n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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>915n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337323
PNG
(5-(1-(3,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-10(4-14(18)6-13)8-23-9-16(21-22-23)11-1-2-15-12(5-11)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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>915n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337321
PNG
(5-(1-(3-methylbenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Cc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C17H15N5/c1-12-3-2-4-13(7-12)10-22-11-17(20-21-22)14-5-6-16-15(8-14)9-18-19-16/h2-9,11H,10H2,1H3,(H,18,19)
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>915n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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923n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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1.28E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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1.30E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337317
PNG
(5-(1-(3-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12ClN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337316
PNG
(5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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>1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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1.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of JAK2 after 1 hr using biotinylated PDKtide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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1.58E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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>1.80E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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1.93E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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2.03E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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2.22E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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2.37E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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2.53E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337318
PNG
(5-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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2.71E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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3.29E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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3.47E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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3.55E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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3.59E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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3.69E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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>3.75E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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3.81E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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3.98E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337316
PNG
(5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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4.15E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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4.27E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Aurora kinase B/Inner centromere protein


(Homo sapiens (Human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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>4.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase 2 after 1 hr using biotinylated kemptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337325
PNG
(5-(3-benzylisoxazol-5-yl)-1H-indazol-3-amine | CHE...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
Show InChI InChI=1S/C17H14N4O/c18-17-14-9-12(6-7-15(14)19-20-17)16-10-13(21-22-16)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H3,18,19,20)
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5.16E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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5.22E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>5.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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>5.45E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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8.36E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337315
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazol-3-am...)
Show SMILES Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Show InChI InChI=1S/C16H14N6/c17-16-13-8-12(6-7-14(13)18-20-16)15-10-22(21-19-15)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H3,17,18,20)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>8.57E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337307
PNG
(5-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H11N5/c1-2-8(1)12-7-17(16-15-12)10-3-4-11-9(5-10)6-13-14-11/h3-8H,1-2H2,(H,13,14)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337305
PNG
(5-(4-(methoxymethyl)-1H-1,2,3-triazol-1-yl)-1H-ind...)
Show SMILES COCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C11H11N5O/c1-17-7-9-6-16(15-13-9)10-2-3-11-8(4-10)5-12-14-11/h2-6H,7H2,1H3,(H,12,14)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337308
PNG
(5-(4-cyclopentyl-1H-1,2,3-triazol-1-yl)-1H-indazol...)
Show SMILES C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C14H15N5/c1-2-4-10(3-1)14-9-19(18-17-14)12-5-6-13-11(7-12)8-15-16-13/h5-10H,1-4H2,(H,15,16)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337309
PNG
(5-(4-(cyclohexylmethyl)-1H-1,2,3-triazol-1-yl)-1H-...)
Show SMILES C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H19N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h6-7,9-12H,1-5,8H2,(H,17,19)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337328
PNG
(5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxaz...)
Show SMILES C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H18N4O/c1-2-6-20(7-3-1)11-14-9-16(21-19-14)12-4-5-15-13(8-12)10-17-18-15/h4-5,8-10H,1-3,6-7,11H2,(H,17,18)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337312
PNG
(5-(4-(3-phenylpropyl)-1H-1,2,3-triazol-1-yl)-1H-in...)
Show SMILES C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
Show InChI InChI=1S/C18H17N5/c1-2-5-14(6-3-1)7-4-8-16-13-23(22-20-16)17-9-10-18-15(11-17)12-19-21-18/h1-3,5-6,9-13H,4,7-8H2,(H,19,21)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337326
PNG
(5-(1H-indazol-5-yl)-3-propylisoxazole | CHEMBL1682...)
Show SMILES CCCc1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337310
PNG
(5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)8-14-11-21(20-18-14)15-6-7-16-13(9-15)10-17-19-16/h1-7,9-11H,8H2,(H,17,19)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337314
PNG
(5-(1-benzyl-1H-1,2,3-triazol-4-yl)-1H-indazole | C...)
Show SMILES C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H13N5/c1-2-4-12(5-3-1)10-21-11-16(19-20-21)13-6-7-15-14(8-13)9-17-18-15/h1-9,11H,10H2,(H,17,18)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337311
PNG
(5-(4-phenethyl-1H-1,2,3-triazol-1-yl)-1H-indazole ...)
Show SMILES C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C17H15N5/c1-2-4-13(5-3-1)6-7-15-12-22(21-19-15)16-8-9-17-14(10-16)11-18-20-17/h1-5,8-12H,6-7H2,(H,18,20)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337324
PNG
(3-benzyl-5-(1H-indazol-5-yl)isoxazole | CHEMBL1682...)
Show SMILES C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-2-4-12(5-3-1)8-15-10-17(21-20-15)13-6-7-16-14(9-13)11-18-19-16/h1-7,9-11H,8H2,(H,18,19)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337327
PNG
(5-(1H-indazol-5-yl)-N-methylisoxazole-3-carboxamid...)
Show SMILES CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H10N4O2/c1-13-12(17)10-5-11(18-16-10)7-2-3-9-8(4-7)6-14-15-9/h2-6H,1H3,(H,13,17)(H,14,15)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337306
PNG
(3-(1-(1H-indazol-5-yl)-1H-1,2,3-triazol-4-yl)propa...)
Show SMILES OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5O/c18-5-1-2-10-8-17(16-14-10)11-3-4-12-9(6-11)7-13-15-12/h3-4,6-8,18H,1-2,5H2,(H,13,15)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337304
PNG
(5-(4-propyl-1H-1,2,3-triazol-1-yl)-1H-indazole | C...)
Show SMILES CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C12H13N5/c1-2-3-10-8-17(16-14-10)11-4-5-12-9(6-11)7-13-15-12/h4-8H,2-3H2,1H3,(H,13,15)
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>8.88E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.02E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337320
PNG
(5-(1-(3-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12FN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.20E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337319
PNG
(5-(1-(2-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C16H12FN5/c17-14-4-2-1-3-12(14)9-22-10-16(20-21-22)11-5-6-15-13(7-11)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.31E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337317
PNG
(5-(1-(3-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H12ClN5/c17-14-3-1-2-11(6-14)9-22-10-16(20-21-22)12-4-5-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.31E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337322
PNG
(5-(1-(2,3-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-1-2-11(16(13)18)8-23-9-15(21-22-23)10-4-5-14-12(6-10)7-19-20-14/h1-7,9H,8H2,(H,19,20)
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2.03E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337329
PNG
(5-(1-(2,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1ccc(Cl)c(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-2-3-14(18)12(6-13)8-23-9-16(21-22-23)10-1-4-15-11(5-10)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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3.60E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337318
PNG
(5-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12ClN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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3.78E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337323
PNG
(5-(1-(3,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-10(4-14(18)6-13)8-23-9-16(21-22-23)11-1-2-15-12(5-11)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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4.15E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337322
PNG
(5-(1-(2,3-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Show InChI InChI=1S/C16H11Cl2N5/c17-13-3-1-2-11(16(13)18)8-23-9-15(21-22-23)10-4-5-14-12(6-10)7-19-20-14/h1-7,9H,8H2,(H,19,20)
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6.76E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50337313
PNG
(5-(1H-1,2,3-triazol-4-yl)-1H-indazole | CHEMBL1682...)
Show SMILES c1[nH]nnc1-c1ccc2n[nH]cc2c1
Show InChI InChI=1S/C9H7N5/c1-2-8-7(4-10-12-8)3-6(1)9-5-11-14-13-9/h1-5H,(H,10,12)(H,11,13,14)
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6.99E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4 after 1 hr using biotinylated L15 peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50337329
PNG
(5-(1-(2,5-dichlorobenzyl)-1H-1,2,3-triazol-4-yl)-1...)
Show SMILES Clc1ccc(Cl)c(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Show InChI InChI=1S/C16H11Cl2N5/c17-13-2-3-14(18)12(6-13)8-23-9-16(21-22-23)10-1-4-15-11(5-10)7-19-20-15/h1-7,9H,8H2,(H,19,20)
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1.27E+5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR after 1 hr


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50337330
PNG
(5-(1-(4-fluorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-in...)
Show SMILES Fc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Show InChI InChI=1S/C16H12FN5/c17-14-4-1-11(2-5-14)9-22-10-16(20-21-22)12-3-6-15-13(7-12)8-18-19-15/h1-8,10H,9H2,(H,18,19)
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1.65E+5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pim1 after 1 hr using biotinylated AL1peptide as substrate


Bioorg Med Chem Lett 21: 1476-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.007
BindingDB Entry DOI: 10.7270/Q2R78FGJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%