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9 similar compounds to monomer 50390638

Compile data set for download or QSAR
Wt: 390.4
BDBM50390654
Wt: 348.8
BDBM50390653
Wt: 312.3
BDBM50390655
Wt: 314.3
BDBM50390639
Wt: 330.8
BDBM50390640
Wt: 310.4
BDBM50390641
Wt: 341.3
BDBM50390642
Wt: 338.4
BDBM50390643
Wt: 342.4
BDBM50390644

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50390654,50390653,50390655,50390639,50390640,50390641,50390642,50390643,50390644   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390639
PNG
(CHEMBL2069712)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2ccc(F)cc2s1
Show InChI InChI=1S/C11H7FN2O2S3/c12-7-1-2-8-9(4-7)18-11(14-8)6-3-10(17-5-6)19(13,15)16/h1-5H,(H2,13,15,16)
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n/an/a 331n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390640
PNG
(CHEMBL2069713)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2ccc(Cl)cc2s1
Show InChI InChI=1S/C11H7ClN2O2S3/c12-7-1-2-8-9(4-7)18-11(14-8)6-3-10(17-5-6)19(13,15)16/h1-5H,(H2,13,15,16)
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n/an/a 355n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390641
PNG
(CHEMBL2069714)
Show SMILES Cc1ccc2nc(sc2c1)-c1csc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H10N2O2S3/c1-7-2-3-9-10(4-7)18-12(14-9)8-5-11(17-6-8)19(13,15)16/h2-6H,1H3,(H2,13,15,16)
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n/an/a 1.26E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390642
PNG
(CHEMBL2069715)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2ccc(cc2s1)[N+]([O-])=O
Show InChI InChI=1S/C11H7N3O4S3/c12-21(17,18)10-3-6(5-19-10)11-13-8-2-1-7(14(15)16)4-9(8)20-11/h1-5H,(H2,12,17,18)
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n/an/a 1.27E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390655
PNG
(CHEMBL2069717)
Show SMILES ONS(=O)(=O)c1cc(cs1)-c1nc2ccccc2s1
Show InChI InChI=1S/C11H8N2O3S3/c14-13-19(15,16)10-5-7(6-17-10)11-12-8-3-1-2-4-9(8)18-11/h1-6,13-14H
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n/an/a 7.42E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390644
PNG
(CHEMBL2069718)
Show SMILES FCCNS(=O)(=O)c1cc(cs1)-c1nc2ccccc2s1
Show InChI InChI=1S/C13H11FN2O2S3/c14-5-6-15-21(17,18)12-7-9(8-19-12)13-16-10-3-1-2-4-11(10)20-13/h1-4,7-8,15H,5-6H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390653
PNG
(CHEMBL2069727)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2ccc(F)c(Cl)c2s1
Show InChI InChI=1S/C11H6ClFN2O2S3/c12-9-6(13)1-2-7-10(9)19-11(15-7)5-3-8(18-4-5)20(14,16)17/h1-4H,(H2,14,16,17)
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n/an/a 672n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390654
PNG
(CHEMBL2069728)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2cccc(-c3ccc(F)cc3)c2s1
Show InChI InChI=1S/C17H11FN2O2S3/c18-12-6-4-10(5-7-12)13-2-1-3-14-16(13)24-17(20-14)11-8-15(23-9-11)25(19,21)22/h1-9H,(H2,19,21,22)
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n/an/a 6.78E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390640
PNG
(CHEMBL2069713)
Show SMILES NS(=O)(=O)c1cc(cs1)-c1nc2ccc(Cl)cc2s1
Show InChI InChI=1S/C11H7ClN2O2S3/c12-7-1-2-8-9(4-7)18-11(14-8)6-3-10(17-5-6)19(13,15)16/h1-5H,(H2,13,15,16)
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n/an/a 4.36E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of Cdk5/p25-mediated myosin heavy chain phosphorylation in HEK293 cells


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (Human))
BDBM50390643
PNG
(CHEMBL2069716)
Show SMILES CC(=O)c1ccc2nc(sc2c1)-c1csc(c1)S(N)(=O)=O
Show InChI InChI=1S/C13H10N2O3S3/c1-7(16)8-2-3-10-11(4-8)20-13(15-10)9-5-12(19-6-9)21(14,17)18/h2-6H,1H3,(H2,14,17,18)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Cdk5/p25 incubated for 15 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5919-23 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.068
BindingDB Entry DOI: 10.7270/Q2G73FTN
More data for this
Ligand-Target Pair