DT-Web

DB02733 - Purvalanol


Identification
Name Purvalanol
Accession Number DB02733 (EXPT02705)
Type small molecule
Description Not Available
Structure
MOL SDF PDB SMILES InChI
Categories (*)
Molecular Weight 432.904
Groups experimental
Monoisotopic Weight 432.167666403
Pharmacology
Indication Not Available
Mechanism of action Not Available
Absorption Not Available
Protein binding Not Available
Biotransformation Not Available
Route of elimination Not Available
Toxicity Not Available
Affected organisms Not Available
Interactions
Drug Interactions Not Available
Food Interactions Not Available

Targets


Cell division control protein 2 homolog
Name Cell division control protein 2 homolog
Gene Name CRK2
Pharmacological action unknown
Actions Not Available
References
  • Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. - Pubmed
  • Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. - Pubmed
DTHybrid score 0.1077
Cell division protein kinase 4
Name Cell division protein kinase 4
Gene Name CDK4
Pharmacological action unknown
Actions Not Available
References
  • Chen X, Ji ZL, Chen YZ: TTD: Therapeutic Target Database. Nucleic Acids Res. 2002 Jan 1;30(1):412-5. - Pubmed
DTHybrid score 0.5689
Mitogen-activated protein kinase 1
Name Mitogen-activated protein kinase 1
Gene Name MAPK1
Pharmacological action unknown
Actions inhibitor
References
  • Chen X, Ji ZL, Chen YZ: TTD: Therapeutic Target Database. Nucleic Acids Res. 2002 Jan 1;30(1):412-5. - Pubmed
DTHybrid score 1.2983
Mitogen-activated protein kinase 3
Name Mitogen-activated protein kinase 3
Gene Name MAPK3
Pharmacological action unknown
Actions inhibitor
References
  • Chen X, Ji ZL, Chen YZ: TTD: Therapeutic Target Database. Nucleic Acids Res. 2002 Jan 1;30(1):412-5. - Pubmed
DTHybrid score 0.5662
Cell division protein kinase 2
Name Cell division protein kinase 2
Gene Name CDK2
Pharmacological action unknown
Actions Not Available
References
  • Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. - Pubmed
  • Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. - Pubmed
  • Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. - Pubmed
DTHybrid score 1.8589
Serine/threonine-protein kinase SRPK2
Name Serine/threonine-protein kinase SRPK2
Gene Name SRPK2
Pharmacological action unknown
Actions Not Available
References
  • Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. - Pubmed
DTHybrid score 0.4437

Predictions


Id Partner name Gene Name Score
6235 Cyclin-A2 CCNA2 0.2743
1152 Glycogen phosphorylase, muscle form PYGM 0.2603
5716 Casein kinase I isoform gamma-2 CSNK1G2 0.1225
6296 Serine/threonine-protein kinase haspin GSG2 0.1143
1742 D-HSCDK2 CDK2deltaT 0.1096
1771 Cell division control protein 2 homolog CDK1 0.1077
1058 Cell division protein kinase 5 CDK5 0.104
3482 Cell division protein kinase 7 CDK7 0.0925
1540 Mitogen-activated protein kinase 14 MAPK14 0.09
3950 Cell division protein kinase 9 CDK9 0.0845
3968 Cell division protein kinase 8 CDK8 0.0845
3955 Cell division protein kinase 6 CDK6 0.0713
1372 Insulin receptor substrate 1 IRS1 0.065
1836 Mitogen-activated protein kinase 10 MAPK10 0.0617
844 Epidermal growth factor receptor EGFR 0.0455
1569 G1/S-specific cyclin-D1 CCND1 0.043
36 Insulin receptor INSR 0.0421
4752 Peroxisomal trans-2-enoyl-CoA reductase PECR 0.0403
6024 Cytochrome P450 1A1 CYP1A1 0.0383
3610 Thioredoxin reductase 1, cytoplasmic TXNRD1 0.0372
6288 Low molecular weight phosphotyrosine protein phosphatase ACP1 0.0359
476 RAC-alpha serine/threonine-protein kinase AKT1 0.0357
4692 A/G-specific adenine glycosylase mutY 0.0333
4606 Purine trans deoxyribosylase ptd 0.0326
1629 Transcription factor AP-1 JUN 0.0326
6043 Putative G-protein coupled receptor 44 GPR44 0.0322
1958 S-methyl-5-thioadenosine phosphorylase MTAP 0.0311
3679 MTA/SAH nucleosidase mtnN 0.031
2038 Inhibitor of nuclear factor kappa-B kinase subunit beta IKBKB 0.0309
128 Adenine phosphoribosyltransferase APRT 0.0291
775 Acetyl-CoA carboxylase 2 ACACB 0.029
4751 Mitogen-activated protein kinase 12 MAPK12 0.0286
1422 Serine/threonine-protein kinase 6 AURKA 0.0269
1502 Peroxisome proliferator-activated receptor delta PPARD 0.0261
1732 ATP-binding cassette sub-family G member 2 ABCG2 0.025
822 Aldose reductase AKR1B1 0.0229
2264 Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase cobT 0.0227
4750 Protein S100-A11 S100A11 0.0216
1898 Cytochrome P450 1B1 CYP1B1 0.0205
2530 Protein kinase C theta type PRKCQ 0.0194
3005 Threonine-phosphate decarboxylase cobD 0.0188
1281 Phosphatidylinositol 3-kinase regulatory subunit alpha PIK3R1 0.0181
1735 Canalicular multispecific organic anion transporter 1 ABCC2 0.0176
6022 UDP-glucuronosyltransferase 1-1 UGT1A1 0.0174
4146 Phosphatidylinositol 3-kinase regulatory subunit gamma PIK3R3 0.0173
4145 Phosphatidylinositol 3-kinase regulatory subunit beta PIK3R2 0.0173
290 Prostaglandin G/H synthase 2 PTGS2 0.0161
2511 MAP kinase-activated protein kinase 2 MAPKAPK2 0.016
1588 Multidrug resistance protein 1 ABCB1 0.0152
20 Prostaglandin G/H synthase 1 PTGS1 0.0151
3390 Aminoglycoside 3'-phosphotransferase aphA 0.0147
6029 Aminoglycoside 3'-phosphotransferase aphA1 0.0147
5646 Galactokinase GALK1 0.0147
5265 FtsH ftsH 0.0147
5302 TrwB trwB 0.0147
587 Serum albumin ALB 0.0142
1729 Solute carrier family 22 member 6 SLC22A6 0.0142
5312 Kinesin-like protein KIF1A KIF1A 0.0134
1721 Glycogen synthase kinase-3 beta GSK3B 0.0131
4512 Cytochrome P450 3A4 CYP3A4 0.0128
1517 Beta-3 adrenergic receptor ADRB3 0.0127
2615 Chemotaxis protein cheA cheA 0.0125
2371 Pantothenate kinase coaA 0.0124
2892 Acetylglutamate kinase argB 0.0124
3550 Acetylglutamate kinase argB 0.0124
825 Arsenical pump-driving ATPase ASNA1 0.0124
3435 Arsenical pump-driving ATPase arsA 0.0124
2950 Inositol-trisphosphate 3-kinase A ITPKA 0.0124
1881 Hexokinase-1 HK1 0.0124
4200 Cytochrome P450 1A2 CYP1A2 0.0122
2207 Rhodopsin RHO 0.0122
2727 S-adenosylmethionine synthetase metK 0.0118
2817 Phosphoribosylglycinamide formyltransferase 2 purT 0.0114
5641 Rod shape-determining protein MreB TM_0588 0.0114
4178 DNA repair protein RAD51 homolog 1 RAD51 0.0114
5645 DNA topoisomerase 4 subunit B parE 0.0114
6227 DNA topoisomerase 4 subunit B parE 0.0114
3794 Osmolarity sensor protein envZ envZ 0.0114
5644 Sensor protein phoQ phoQ 0.0114
5643 General secretion pathway protein E epsE 0.0114
5642 Chaperone clpB clpB 0.0114
5649 Potassium-transporting ATPase B chain kdpB 0.0114
2251 Thymidylate kinase tmk 0.0102
2254 Thymidylate kinase DTYMK 0.0102
3522 Thymidylate kinase tmk 0.0102
6263 cAMP-dependent protein kinase catalytic subunit alpha PRKACA 0.0102
207 Glutathione synthetase GSS 0.01
5269 Glutathione synthetase gshB 0.01
2184 Cystic fibrosis transmembrane conductance regulator CFTR 0.0099
2867 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase ispE 0.0098
740 Argininosuccinate synthase ASS1 0.0097
865 Argininosuccinate synthase ASS1 0.0097
2680 Argininosuccinate synthase argG 0.0097
3194 Argininosuccinate synthase argG 0.0097
6433 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase 4 PFKFB4 0.0097
2397 Dihydroxyacetone kinase dhaK 0.0097
2852 DNA mismatch repair protein mutL mutL 0.0097
3822 Actin, alpha skeletal muscle ACTA1 0.0094
2299 UDP-N-acetylmuramate--L-alanine ligase murC 0.009
3231 Death-associated protein kinase 1 DAPK1 0.009
4373 Medium-chain-fatty-acid--CoA ligase Not Available 0.0089
193 Beta-1 adrenergic receptor ADRB1 0.0086
936 Ephrin type-A receptor 2 EPHA2 0.0084
887 DNA gyrase subunit B gyrB 0.0083
4150 DNA gyrase subunit B gyrB 0.0083
6225 DNA gyrase subunit B gyrB 0.0083
766 Beta-2 adrenergic receptor ADRB2 0.0083
937 Proto-oncogene tyrosine-protein kinase LCK LCK 0.0081
958 Insulin-like growth factor 1 receptor IGF1R 0.0076
2347 Proto-oncogene serine/threonine-protein kinase Pim-1 PIM1 0.0074
4192 DNA topoisomerase 2-beta TOP2B 0.007
2236 Casein kinase II subunit alpha CSNK2A1 0.0059
5304 UPF0166 protein TM_0021 TM_0021 0.0053
5266 Activator of hgdC 0.0053
5314 UPF0079 ATP-binding protein HI0065 HI_0065 0.0053
5293 Shikimate kinase 2 aroL 0.0053
2874 Nitrogenase iron protein 1 nifH1 0.0053
5287 Signaling protein Not Available 0.0053
5292 Putative partitioning protein TT_C1605 0.0053
3199 Phosphopantetheine adenylyltransferase coaD 0.0053
3543 Phosphopantetheine adenylyltransferase coaD 0.0053
3567 Phosphopantetheine adenylyltransferase coaD 0.0053
5289 Phosphopantetheine adenylyltransferase coaD 0.0053
4346 Polynucleotide kinase pseT 0.0053
5283 D-alanine--D-alanine ligase B ddlB 0.0053
5288 Shikimate kinase aroK 0.0053
5281 Plasmid segregation protein parM parM 0.0053
5305 Phosphoribosylaminoimidazole carboxylase ATPase subunit purK 0.0053
5299 D-alanine--D-alanine ligase ddl 0.0053
6598 D-alanine--D-alanine ligase ddl 0.0053
5275 Multidrug resistance ABC transporter ATP-binding and permease protein lmrA 0.0053
5276 Chromosomal replication initiator protein dnaA dnaA 0.0053
5259 Transcriptional regulator ntrC1 0.0053
6699 Transcriptional regulator Cgl2612 0.0053
5290 ATP-dependent hsl protease ATP-binding subunit hslU hslU 0.0053
5638 ATP-dependent hsl protease ATP-binding subunit hslU hslU 0.0053
5270 ATP-dependent Clp protease ATP-binding subunit clpX clpX 0.0053
5284 Large T antigen Not Available 0.0053
5291 Glycogen synthase 1 glgA1 0.0053
5264 DNA replication protein REP 0.0053
4794 Phosphoenolpyruvate carboxykinase [ATP] pckA 0.0053
5285 Kinesin heavy chain KIF5B 0.0053
5315 Chaperone protein htpG htpG 0.0053
1549 Heat shock 70 kDa protein 1 HSPA1A 0.0053
5277 Preprotein translocase subunit secA secA 0.0053
3777 ATP-dependent Clp protease ATP-binding subunit clpA clpA 0.0053
5308 Preprotein translocase secA 1 subunit secA1 0.0053
3982 Phosphoribosylformylglycinamidine synthase PFAS 0.0053
5261 Phosphoribosylformylglycinamidine synthase purL 0.0053
6321 Cyclin-dependent kinase 5 activator 1 CDK5R1 0.0049
4837 Cag-alfa cag-alfa 0.0045
4774 NTPase P4 Not Available 0.0045
6277 Heat shock cognate 71 kDa protein HSPA8 0.0045
4839 DNA polymerase III subunit tau dnaX 0.0045
4838 PMS1 protein homolog 2 PMS2 0.0044
2270 Dephospho-CoA kinase coaE 0.0044
5189 Trimethylamine dehydrogenase tmd 0.0044
2284 Adenylate kinase adk 0.0044
2296 Adenylate kinase adk 0.0044
2311 Adenylate kinase adk 0.0044
2312 Adenylate kinase Not Available 0.0044
4106 Guanylate kinase GUK1 0.0044
4516 Guanylate kinase gmk 0.0044
413 Amidophosphoribosyltransferase PPAT 0.0044
2515 Amidophosphoribosyltransferase purF 0.0044
3714 Amidophosphoribosyltransferase purF 0.0044
3470 Hypothetical protein MG245 homolog MPN_348 0.0044
5295 2-keto-3-deoxy-gluconate kinase TT_P0036 0.0044
2751 Holliday junction ATP-dependent DNA helicase ruvB ruvB 0.0044
4755 Holliday junction ATP-dependent DNA helicase ruvB ruvB 0.0044
3426 Glutamine synthetase glnA 0.0044
3987 Glutamine synthetase GLUL 0.0044
3175 Glutamate--cysteine ligase gshA 0.0044
2317 UDP-N-acetylmuramoylalanine--D-glutamate ligase murD 0.0043
340 Apoptotic protease-activating factor 1 APAF1 0.0042
2683 Mono-ADP-ribosyltransferase C3 C3 0.0041
2390 Nonsecretory ribonuclease RNASE2 0.0041
5300 Antigen peptide transporter 1 TAP1 0.004
2922 Glycerol kinase glpK 0.004
5271 Focal adhesion kinase 1 PTK2 0.004
2282 Protein recA recA 0.0039
2315 Protein recA recA 0.0039
2332 Protein recA recA 0.0039
5263 Protein recA recA 0.0039
408 Riboflavin kinase RFK 0.0038
5278 Bifunctional 3'-phosphoadenosine 5'-phosphosulfate synthetase 1 PAPSS1 0.0038
4366 Riboflavin kinase/FMN adenylyltransferase TM_0857 0.0038
3669 Ribokinase rbsK 0.0037
6857 [Pyruvate dehydrogenase [lipoamide]] kinase isozyme 2, mitochondrial PDK2 0.0037
6390 Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 ATP2A1 0.0036
137 FolC bifunctional protein [Includes: Folylpolyglutamate synthase folC 0.0036
788 Creatine kinase M-type CKM 0.0035
2697 Uridine-cytidine kinase 2 UCK2 0.0034
2334 Dethiobiotin synthetase bioD 0.0034
6555 Dethiobiotin synthetase bioD 0.0034
61 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase folK 0.0034
2644 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase folK 0.0034
2710 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase folK 0.0034
453 S-adenosylmethionine synthetase isoform type-1 MAT1A 0.0033
48 Pyridoxal kinase PDXK 0.0032
6893 Calcium/calmodulin-dependent protein kinase type II gamma chain CAMK2G 0.0032
702 UMP-CMP kinase CMPK1 0.0032
201 Glutamate dehydrogenase 1, mitochondrial GLUD1 0.0032
2091 Endoplasmin HSP90B1 0.0031
6395 Myosin-14 MYH14 0.0031
6824 Tyrosine-protein kinase Lyn LYN 0.003
3379 Kinesin-like protein KIF11 KIF11 0.0029
3456 Heat shock protein HSP 90-beta HSP90AB1 0.0029
2599 Tyrosine-protein kinase HCK HCK 0.0028
504 Mast/stem cell growth factor receptor KIT 0.0028
509 Thymidine kinase TK 0.0028
570 Thymidine kinase TK 0.0028
2559 Thymidine kinase TK 0.0028
3430 Thymidine kinase tdk 0.0028
3518 Thymidine kinase TK 0.0028
5301 Thymidine kinase tdk 0.0028
5771 Thymidine kinase ORF36 0.0028
7009 Thymidine kinase ORF36 0.0028
5294 Nucleoside diphosphate kinase A NME1 0.0027
4773 Deoxycytidine kinase DCK 0.0026
2473 Tyrosine-protein kinase CSK CSK 0.0026
2398 Tyrosine-protein kinase ZAP-70 ZAP70 0.0026
631 3-hydroxy-3-methylglutaryl-coenzyme A reductase HMGCR 0.0025
3387 3-hydroxy-3-methylglutaryl-coenzyme A reductase mvaA 0.0025
5682 Ribonuclease pancreatic RNASE1 0.0025
990 Dual specificity mitogen-activated protein kinase kinase 1 MAP2K1 0.0024
4341 Beta crystallin B1 CRYBB1 0.0024
4340 Hypothetical conserved protein GK2698 0.0024
6484 Hypothetical conserved protein TT_C0834 0.0024
4339 Sucrose phosphorylase sucP 0.0024
1434 Protein DJ-1 PARK7 0.0024
4336 Glyceraldehyde 3-phosphate dehydrogenase Not Available 0.0024
4436 Glyceraldehyde 3-phosphate dehydrogenase tthHB8IM 0.0024
1939 Heat shock protein HSP 90-alpha HSP90AA1 0.0022
2450 Tyrosine-protein kinase ITK/TSK ITK 0.0022
3421 Hydroxyethylthiazole kinase thiM 0.0021
2688 Peptide deformylase def 0.0021
2708 Peptide deformylase def 0.0021
3004 Peptide deformylase def 0.0021
4337 Peptide deformylase def 0.0021
4338 Peptide deformylase def 0.0021
5368 Peptide deformylase def 0.0021
5371 Peptide deformylase def 0.0021
6375 Peptide deformylase def 0.0021
6378 Peptide deformylase def 0.0021
6379 Peptide deformylase def 0.0021
6776 Peptide deformylase def 0.0021
6900 Peptide deformylase def 0.0021
17 Proto-oncogene tyrosine-protein kinase ABL1 ABL1 0.002
3105 M-phase inducer phosphatase 2 CDC25B 0.0019
4343 Alpha-glucosidase aglA 0.0019
2408 Tyrosine-protein kinase SYK SYK 0.0018
3168 Beta-lactamase OXA-1 bla 0.0018
4819 Hydrolase Not Available 0.0018
5249 Hydrolase Not Available 0.0018
5436 Hydrolase Not Available 0.0018
3230 Non-ATP-dependent L-selective hydantoinase lhyD 0.0018
3122 D-hydantoinase Not Available 0.0018
3145 D-hydantoinase hyuA 0.0018
933 Proto-oncogene tyrosine-protein kinase Src SRC 0.0017
2840 Beta-lactamase IMP-1 Not Available 0.0017
2404 Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform PIK3CG 0.0016
3873 Prolyl endopeptidase PREP 0.0015
6928 Prolyl endopeptidase Not Available 0.0015
3237 Beta-lactamase OXA-2 bla 0.0015
3292 Alanine racemase, catabolic dadX 0.0015
3281 Isoaspartyl dipeptidase iadA 0.0015
4264 Alpha-L-fucosidase, putative TM_0306 0.0015
2180 3-phosphoinositide-dependent protein kinase 1 PDPK1 0.0015
2801 UDP-N-acetylmuramoylalanyl-D-glutamate--2,6-diaminopimelate ligase murE 0.0014
2983 Methylmalonyl-CoA carboxyltransferase 5S subunit Not Available 0.0014
4549 Endonuclease III HP_0602 0.0013
2646 Dihydroorotase pyrC 0.0013
2717 Folylpolyglutamate synthase fgs 0.0013
2340 Beta-lactamase PSE-2 bla 0.0012
2796 Parathion hydrolase opd 0.0012
6539 Parathion hydrolase opd 0.0012
894 Alanine racemase alr 0.0012
2453 Alanine racemase alr 0.0012
687 Tyrosine-protein phosphatase non-receptor type 1 PTPN1 0.0011
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