Found 12 hits Enz. Inhib. hit(s) with all data for entry = 4263 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8061
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 32 | 4...)Show InChI InChI=1S/C14H12N6O2S/c1-8-12(23-13(15)17-8)11-5-6-16-14(19-11)18-9-3-2-4-10(7-9)20(21)22/h2-7H,1H3,(H2,15,17)(H,16,18,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8061
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 32 | 4...)Show InChI InChI=1S/C14H12N6O2S/c1-8-12(23-13(15)17-8)11-5-6-16-14(19-11)18-9-3-2-4-10(7-9)20(21)22/h2-7H,1H3,(H2,15,17)(H,16,18,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8066
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 37 | 4...)Show InChI InChI=1S/C17H19N5S/c1-11-16(23-12(2)19-11)15-9-10-18-17(21-15)20-13-5-7-14(8-6-13)22(3)4/h5-10H,1-4H3,(H,18,20,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
MMDB
PDB
Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8066
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 37 | 4...)Show InChI InChI=1S/C17H19N5S/c1-11-16(23-12(2)19-11)15-9-10-18-17(21-15)20-13-5-7-14(8-6-13)22(3)4/h5-10H,1-4H3,(H,18,20,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM59236
(N-(3-nitrophenyl)-4-[3-(1H-1,2,4-triazol-1-ylmethy...)Show SMILES O=N(=O)c1cccc(Nc2nccc(n2)-c2cccc(Cn3cncn3)c2)c1 Show InChI InChI=1S/C19H15N7O2/c27-26(28)17-6-2-5-16(10-17)23-19-21-8-7-18(24-19)15-4-1-3-14(9-15)11-25-13-20-12-22-25/h1-10,12-13H,11H2,(H,21,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| KEGG
MMDB
PC cid
PC sid
UniChem
Patents
| MMDB
Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM59236
(N-(3-nitrophenyl)-4-[3-(1H-1,2,4-triazol-1-ylmethy...)Show SMILES O=N(=O)c1cccc(Nc2nccc(n2)-c2cccc(Cn3cncn3)c2)c1 Show InChI InChI=1S/C19H15N7O2/c27-26(28)17-6-2-5-16(10-17)23-19-21-8-7-18(24-19)15-4-1-3-14(9-15)11-25-13-20-12-22-25/h1-10,12-13H,11H2,(H,21,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| KEGG
MMDB
PC cid
PC sid
UniChem
Patents
| MMDB
Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8049
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 20 | 4...)Show SMILES Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C16H13F3N4S/c1-9-14(24-10(2)21-9)13-7-8-20-15(23-13)22-12-5-3-11(4-6-12)16(17,18)19/h3-8H,1-2H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
MMDB
PDB
Article
PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8049
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 20 | 4...)Show SMILES Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C16H13F3N4S/c1-9-14(24-10(2)21-9)13-7-8-20-15(23-13)22-12-5-3-11(4-6-12)16(17,18)19/h3-8H,1-2H3,(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
Article
PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50277583
(2-amino-4-methyl-1,3-thiazol-5-yl)-N-[4-(morpholin...)Show InChI InChI=1S/C18H20N6OS/c1-12-16(26-17(19)21-12)15-6-7-20-18(23-15)22-13-2-4-14(5-3-13)24-8-10-25-11-9-24/h2-7H,8-11H2,1H3,(H2,19,21)(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| MMDB
Article
PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50277583
(2-amino-4-methyl-1,3-thiazol-5-yl)-N-[4-(morpholin...)Show InChI InChI=1S/C18H20N6OS/c1-12-16(26-17(19)21-12)15-6-7-20-18(23-15)22-13-2-4-14(5-3-13)24-8-10-25-11-9-24/h2-7H,8-11H2,1H3,(H2,19,21)(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| MMDB
Article
PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8037
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 8 | 4-...)Show InChI InChI=1S/C9H10N4S/c1-5-8(14-6(2)12-5)7-3-4-11-9(10)13-7/h3-4H,1-2H3,(H2,10,11,13) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | 6.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM8037
(2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 8 | 4-...)Show InChI InChI=1S/C9H10N4S/c1-5-8(14-6(2)12-5)7-3-4-11-9(10)13-7/h3-4H,1-2H3,(H2,10,11,13) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 6.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Cyclacel Ltd
| Assay Description
In vitro inhibition assay using human recombinant CDK2 and human recombinant cyclin A2. |
Chem Biol 13: 201-11 (2006)
Article DOI: 10.1016/j.chembiol.2005.11.011
BindingDB Entry DOI: 10.7270/Q2542M16 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
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