BDBM50378820 CHEMBL1241567
SMILES: CCCCOc1c(ccc2[nH]ncc12)C(=O)c1c(F)cc(C)cc1F
InChI Key: InChIKey=BDKLBVUOSJBBMO-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50378820 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 4
(Homo sapiens (Human)) | BDBM50378820
(CHEMBL1241567)Show SMILES CCCCOc1c(ccc2[nH]ncc12)C(=O)c1c(F)cc(C)cc1F Show InChI InChI=1S/C19H18F2N2O2/c1-3-4-7-25-19-12(5-6-16-13(19)10-22-23-16)18(24)17-14(20)8-11(2)9-15(17)21/h5-6,8-10H,3-4,7H2,1-2H3,(H,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgetown University
Curated by ChEMBL
| Assay Description Inhibition of CDK4 |
AAPS J 8: 204-21 (2006)
Article DOI: 10.1208/aapsj080125 BindingDB Entry DOI: 10.7270/Q2TX3GBS |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50378820
(CHEMBL1241567)Show SMILES CCCCOc1c(ccc2[nH]ncc12)C(=O)c1c(F)cc(C)cc1F Show InChI InChI=1S/C19H18F2N2O2/c1-3-4-7-25-19-12(5-6-16-13(19)10-22-23-16)18(24)17-14(20)8-11(2)9-15(17)21/h5-6,8-10H,3-4,7H2,1-2H3,(H,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgetown University
Curated by ChEMBL
| Assay Description Inhibition of CDK2 |
AAPS J 8: 204-21 (2006)
Article DOI: 10.1208/aapsj080125 BindingDB Entry DOI: 10.7270/Q2TX3GBS |
More data for this Ligand-Target Pair | |