Found 3 hits for monomerid = 50444929 Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50444929
(CHEMBL3099742)Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc(C(=O)NS(C)(=O)=O)c2cc(ccc2n1)-c1cccs1 |r| Show InChI InChI=1S/C26H23N3O7S2/c1-36-26(33)22(12-15-5-8-17(30)9-6-15)28-25(32)21-14-19(24(31)29-38(2,34)35)18-13-16(7-10-20(18)27-21)23-4-3-11-37-23/h3-11,13-14,22,30H,12H2,1-2H3,(H,28,32)(H,29,31)/t22-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Displacement of B-Alexa-Fluor647 from CDK2 (unknown origin) by fluorescence polarization assay |
Bioorg Med Chem Lett 24: 199-203 (2013)
Article DOI: 10.1016/j.bmcl.2013.11.041 BindingDB Entry DOI: 10.7270/Q2SN0BF8 |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50444929
(CHEMBL3099742)Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc(C(=O)NS(C)(=O)=O)c2cc(ccc2n1)-c1cccs1 |r| Show InChI InChI=1S/C26H23N3O7S2/c1-36-26(33)22(12-15-5-8-17(30)9-6-15)28-25(32)21-14-19(24(31)29-38(2,34)35)18-13-16(7-10-20(18)27-21)23-4-3-11-37-23/h3-11,13-14,22,30H,12H2,1-2H3,(H,28,32)(H,29,31)/t22-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Binding affinity to CDK2 (unknown origin) at 20 to 80 degC by circular dichroism analysis |
Bioorg Med Chem Lett 24: 199-203 (2013)
Article DOI: 10.1016/j.bmcl.2013.11.041 BindingDB Entry DOI: 10.7270/Q2SN0BF8 |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50444929
(CHEMBL3099742)Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc(C(=O)NS(C)(=O)=O)c2cc(ccc2n1)-c1cccs1 |r| Show InChI InChI=1S/C26H23N3O7S2/c1-36-26(33)22(12-15-5-8-17(30)9-6-15)28-25(32)21-14-19(24(31)29-38(2,34)35)18-13-16(7-10-20(18)27-21)23-4-3-11-37-23/h3-11,13-14,22,30H,12H2,1-2H3,(H,28,32)(H,29,31)/t22-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | 25 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of CDK2 (unknown origin)-cyclin A interaction preincubated for 30 mins at room temperature followed by incubation at 40 degC for 30 mins b... |
Bioorg Med Chem Lett 24: 199-203 (2013)
Article DOI: 10.1016/j.bmcl.2013.11.041 BindingDB Entry DOI: 10.7270/Q2SN0BF8 |
More data for this Ligand-Target Pair | |