TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T85799 Cyclin-dependent kinase 4 D05ADP R-roscovitine Phase 2 160355 C19H26N6O 354.4 CC[C@H](CO)NC1=NC(=C2C(=N1)N(C=N2)C(C)C)NCC3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T85799 Cyclin-dependent kinase 4 D00BPA Olomoucine Terminated 4592 C15H18N6O 298.34 CN1C=NC2=C(N=C(N=C21)NCCO)NCC3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T85799 Cyclin-dependent kinase 4 B34WHP 4,6 Bis anilino pyrimidine deriv. 9 Investigative 6539013 C22H27N5O3 409.5 CN(C)CC(COC1=CC=C(C=C1)NC2=NC=NC(=C2)NC3=CC=C(C=C3)OC)O IC50 = 57000 nM Poor binder T85799 Cyclin-dependent kinase 4 B3A9GH (3r)-1-{2-[4-(4-Acetylphenyl)piperazin-1-Yl]-2-Oxoethyl}-N-(3-Chloro-4-Hydroxyphenyl)pyrrolidine-3-Carboxamide Investigative 58985201 C25H29ClN4O4 485 CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CN3CC[C@H](C3)C(=O)NC4=CC(=C(C=C4)O)Cl IC50 ~ 50000 nM Poor binder T85799 Cyclin-dependent kinase 4 B5JCH6 [(1S,3Ar,6E,9S,9aR,10R,11aS)-6-[[tert-butyl(2-hydroxyethyl)amino]methylidene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate Investigative 24807809 C29H41NO9 547.6 CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N(CCO)C(C)(C)C)/C4=C(C3=O)O)COC)C)C IC50 ~ 50000 nM Poor binder T85799 Cyclin-dependent kinase 4 B9QZ2W 1-(2-Amino-6-(2,6-dichlorophenyl)pyrido[2,3-d]pyrimidin-7-yl)-3-(tert-butyl)urea Investigative 5328112 C18H18Cl2N6O 405.3 CC(C)(C)NC(=O)NC1=C(C=C2C=NC(=NC2=N1)N)C3=C(C=CC=C3Cl)Cl IC50 ~ 50000 nM Poor binder T85799 Cyclin-dependent kinase 4 B9RCI4 2-(2,6-Dichloro-phenylamino)-7-(3-diethylamino-propenyl)-1,6-dimethyl-1,8-dihydro-imidazo[4,5-h]isoquinolin-9-one Investigative 9869943 C25H27Cl2N5O 484.4 CCN(CC)C/C=C/C1=C(C2=C(C3=C(C=C2)N=C(N3C)NC4=C(C=CC=C4Cl)Cl)C(=O)N1)C IC50 ~ 100000 nM Poor binder T85799 Cyclin-dependent kinase 4 BP1B6K Carbazole deriv. 22 Investigative 5330890 C22H16N2O 324.4 C1=CC(=CC(=C1)N)C2=CC=CC3=C2NC4=C3C5=C(C=CC(=C5)O)C=C4 IC50 = 74500 nM Poor binder T85799 Cyclin-dependent kinase 4 BRE4P2 (1E,4S,4Ar,5R,6aS,7S,9aR)-5-(acetyloxy)-1-[[[3-(dimethylamino)propyl]methylamino]methylene]-4a,5,6,6a,7,8,9,9a-octahydro-cyclopenta[5,6]naphtho[1,2-c]pyran-2,10(1H,4H)-dione Investigative 11526786 C29H42N2O8 546.7 CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N(C)CCCN(C)C)/C4=C(C3=O)O)COC)C)C IC50 ~ 50000 nM Poor binder T85799 Cyclin-dependent kinase 4 D0YZ7H JNJ-10198409 Investigative 9797370 C18H16FN3O2 325.3 COC1=C(C=C2C(=C1)CC3=C2NN=C3NC4=CC(=CC=C4)F)OC IC50 ~ 100000 nM Poor binder