Detailed information for compound 1723066

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 405.493 | Formula: C23H27N5O2
  • H donors: 2 H acceptors: 3 LogP: 2.96 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1cccc2c1C1CCCCN1C2=O)Nc1cccc(n1)N1CCCCC1
  • InChi: 1S/C23H27N5O2/c29-22-16-8-6-9-17(21(16)18-10-2-5-15-28(18)22)24-23(30)26-19-11-7-12-20(25-19)27-13-3-1-4-14-27/h6-9,11-12,18H,1-5,10,13-15H2,(H2,24,25,26,30)
  • InChiKey: WDKKKLHFWNLZLI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cyclin-dependent kinase 5 Starlite/ChEMBL References
Homo sapiens dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A Starlite/ChEMBL References
Homo sapiens cyclin-dependent kinase 5, regulatory subunit 1 (p35) References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus dual specificity Get druggable targets OG5_127901 All targets in OG5_127901
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma congolense cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania major cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
Cryptosporidium parvum Cdc2-like CDK2/CDC28 like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127901 All targets in OG5_127901
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium yoelii cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium berghei cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei gambiense serine/threonine-protein kinase, putative,protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127901 All targets in OG5_127901
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Echinococcus granulosus cyclin dependent kinase 5 activator 1 Get druggable targets OG5_133447 All targets in OG5_133447
Leishmania mexicana cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 5 activator 1 Get druggable targets OG5_133447 All targets in OG5_133447
Brugia malayi hypothetical protein Get druggable targets OG5_133447 All targets in OG5_133447
Leishmania infantum serine/threonine-protein kinase, putative,protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase Get druggable targets OG5_127901 All targets in OG5_127901
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127901 All targets in OG5_127901
Plasmodium vivax protein kinase Crk2 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma congolense serine/threonine-protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Schistosoma japonicum expressed protein Get druggable targets OG5_127901 All targets in OG5_127901
Trypanosoma brucei gambiense cell division related protein kinase 2, putative,CDC2-related protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum ko:K02090 cyclin-dependent kinase 5, putative Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133447 All targets in OG5_133447
Trypanosoma cruzi CMGC/DYRK protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania braziliensis cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei gambiense cell division protein kinase 2 homolog 1,cdc2- like protein kinase, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis dual specificity Get druggable targets OG5_127901 All targets in OG5_127901
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Neospora caninum CMGC kinase, CDK family TgPK2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127901 All targets in OG5_127901
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133447 All targets in OG5_133447
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133447 All targets in OG5_133447
Brugia malayi Protein kinase domain containing protein Get druggable targets OG5_127901 All targets in OG5_127901
Plasmodium knowlesi Cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani serine/threonine-protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania major cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium falciparum protein kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Babesia bovis cell division control protein 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma congolense cdc2-related kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei CMGC/DYRK protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania braziliensis serine/threonine-protein kinase, putative,protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Schistosoma japonicum ko:K02087 cyclin-dependent kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Cryptosporidium hominis cdc2-like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania braziliensis cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum Serine/threonine-protein kinase minibrain, putative Get druggable targets OG5_127901 All targets in OG5_127901
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum hypothetical protein Get druggable targets OG5_133447 All targets in OG5_133447
Schistosoma japonicum Cyclin-dependent kinase 5 activator 2 precursor, putative Get druggable targets OG5_133447 All targets in OG5_133447
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania mexicana serine/threonine-protein kinase, putative,protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Trypanosoma congolense serine/threonine-protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Trypanosoma brucei cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni cyclin-dependent kinase 5 activator Get druggable targets OG5_133447 All targets in OG5_133447
Leishmania mexicana cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Theileria parva cell division control protein 2 related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi Protein kinase domain containing protein Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi CMGC/DYRK protein kinase, putative Get druggable targets OG5_127901 All targets in OG5_127901
Leishmania donovani cell division protein kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei mitogen-activated protein kinase 5 cyclin-dependent kinase 5 260 aa 307 aa 28.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis aldehyde reductase 0.0024 0.0532 0.0532
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0898 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0034 0.0862 0.381
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0898 0.1242
Entamoeba histolytica hypothetical protein 0.0108 0.3326 0.4563
Entamoeba histolytica protein kinase domain containing protein 0.0108 0.3326 0.4563
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.1474 0.4343
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0053 0.1474 0.4343
Loa Loa (eye worm) hypothetical protein 0.0069 0.2031 0.1988
Trichomonas vaginalis aldo-keto reductase, putative 0.001 0.0053 0.0235
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.1474 0.4343
Brugia malayi beta-lactamase family protein 0.0035 0.0898 0.1078
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0898 0.1242
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0898 0.1078
Echinococcus granulosus dual specificity 0.0108 0.3326 0.3326
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Onchocerca volvulus 0.0034 0.0862 0.9575
Mycobacterium tuberculosis Probable oxidoreductase 0.0034 0.0862 0.1193
Giardia lamblia Kinase, CMGC CDK 0.0053 0.1474 0.437
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Entamoeba histolytica hypothetical protein 0.0226 0.7226 1
Brugia malayi beta-lactamase family protein 0.0035 0.0898 0.1078
Onchocerca volvulus 0.0034 0.0862 0.9575
Echinococcus granulosus cyclin dependent kinase 5 0.0053 0.1474 0.1474
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Trypanosoma cruzi aldo-keto reductase 0.0034 0.0862 0.2472
Onchocerca volvulus 0.0034 0.0862 0.9575
Echinococcus granulosus geminin 0.0183 0.5815 0.5815
Brugia malayi hypothetical protein 0.0226 0.7226 0.9148
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.0108 0.3326 0.329
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.1474 0.1474
Mycobacterium ulcerans oxidoreductase 0.0034 0.0862 0.96
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Schistosoma mansoni hypothetical protein 0.0204 0.6514 0.6514
Toxoplasma gondii aldose reductase, putative 0.0034 0.0862 0.5692
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0076 0.2263 0.6753
Entamoeba histolytica aldose reductase, putative 0.0034 0.0862 0.1128
Onchocerca volvulus 0.0035 0.0898 1
Echinococcus multilocularis cyclin dependent kinase 5 0.0053 0.1474 0.1474
Entamoeba histolytica hypothetical protein 0.0226 0.7226 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0898 0.3968
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0053 0.1474 0.4343
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.1474 0.1474
Schistosoma mansoni zinc finger protein 0.0015 0.0223 0.0223
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0898 0.5944
Echinococcus multilocularis aldo keto reductase 0.0034 0.0862 0.0862
Mycobacterium tuberculosis Conserved protein 0.0035 0.0898 0.1242
Schistosoma mansoni serine/threonine protein kinase 0.0108 0.3326 0.3326
Loa Loa (eye worm) beta-lactamase 0.0035 0.0898 0.0849
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0898 0.3968
Schistosoma mansoni hypothetical protein 0.0183 0.5815 0.5815
Echinococcus multilocularis aldo keto reductase 0.0034 0.0862 0.0862
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0034 0.0862 0.2472
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0459 0.0459
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0898 0.1242
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Mycobacterium ulcerans lipase LipD 0.0035 0.0898 1
Schistosoma mansoni zinc finger protein 0.0019 0.0362 0.0362
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0898 0.2582
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0246 0.7894 0.7883
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0034 0.0862 0.96
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0898 0.3968
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.028 0.028
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0459 0.0459
Echinococcus granulosus zinc finger protein 0.0019 0.0362 0.0362
Echinococcus multilocularis kelch ECH associated protein 1 0.0204 0.6495 0.6495
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0053 0.0235
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Trypanosoma brucei aldo-keto reductase, putative 0.0034 0.0862 0.2472
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0108 0.3326 1
Trypanosoma brucei ISWI complex protein 0.0015 0.0223 0.0517
Onchocerca volvulus 0.0034 0.0862 0.9575
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0898 0.3968
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Echinococcus multilocularis dual specificity 0.0108 0.3326 0.3326
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.028 0.028
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0898 0.1242
Echinococcus granulosus cyclin dependent kinase 1 0.0053 0.1474 0.1474
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.1671 0.1671
Onchocerca volvulus 0.0034 0.0862 0.9575
Loa Loa (eye worm) hypothetical protein 0.0148 0.4643 0.4614
Mycobacterium leprae Possible oxidoreductase 0.001 0.0053 0.0593
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0076 0.2263 0.2263
Trypanosoma brucei prostaglandin f synthase 0.0034 0.0862 0.2472
Entamoeba histolytica aldose reductase, putative 0.0034 0.0862 0.1128
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0076 0.2263 0.2819
Trypanosoma cruzi ISWI complex protein 0.0015 0.0223 0.0517
Loa Loa (eye worm) hypothetical protein 0.0017 0.028 0.0228
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1474 0.6515
Loa Loa (eye worm) oxidoreductase 0.0034 0.0862 0.0813
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0076 0.2263 0.2263
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0226 0.7226 0.7226
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.1474 0.1474
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0076 0.2263 0.6753
Trichomonas vaginalis aldo-keto reductase, putative 0.001 0.0053 0.0235
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0226 0.7226 0.7226
Schistosoma mansoni hypothetical protein 0.0183 0.5815 0.5815
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0034 0.0862 0.1032
Echinococcus multilocularis aldo keto reductase 0.0034 0.0862 0.0862
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0898 0.0898
Echinococcus granulosus ubiquitin specific protease 41 0.0076 0.2263 0.2263
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0459 0.0459
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0898 0.0898
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0898 0.1242
Loa Loa (eye worm) hypothetical protein 0.0052 0.1437 0.1392
Loa Loa (eye worm) oxidoreductase 0.0034 0.0862 0.0813
Echinococcus granulosus kelch ECH associated protein 1 0.0204 0.6495 0.6495
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Echinococcus granulosus voltage gated potassium channel subunit 0.001 0.0053 0.0053
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0053 0.1474 0.1429
Echinococcus multilocularis aldo keto reductase 0.0034 0.0862 0.0862
Plasmodium falciparum protein kinase 5 0.0053 0.1474 1
Mycobacterium leprae Probable lipase LipE 0.0035 0.0898 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.028 0.028
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Loa Loa (eye worm) oxidoreductase 0.0034 0.0862 0.0813
Schistosoma mansoni bromodomain containing protein 0.0062 0.1788 0.1788
Onchocerca volvulus 0.0035 0.0898 1
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.03 0.0248
Loa Loa (eye worm) hypothetical protein 0.0107 0.3289 0.3253
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Entamoeba histolytica protein kinase, putative 0.0108 0.3326 0.4563
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0053 0.1474 1
Trypanosoma brucei cdc2-related kinase 3 0.0053 0.1474 0.4343
Brugia malayi Bromodomain containing protein 0.0038 0.0973 0.1173
Toxoplasma gondii ABC1 family protein 0.0035 0.0898 0.5944
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.028 0.028
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Trypanosoma brucei cdc2-related kinase 1 0.0053 0.1474 0.4343
Leishmania major hypothetical protein, conserved 0.0015 0.0223 0.0517
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.1671 0.1671
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0076 0.2263 1
Mycobacterium tuberculosis Conserved protein 0.001 0.0053 0.0074
Brugia malayi Protein kinase domain containing protein 0.0053 0.1474 0.1813
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.1474 0.1982
Brugia malayi PHD-finger family protein 0.0024 0.0536 0.0616
Entamoeba histolytica hypothetical protein 0.0226 0.7226 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0108 0.3326 1
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0898 0.1242
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0076 0.2263 0.2263
Trypanosoma cruzi ISWI complex protein 0.0015 0.0223 0.0517
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0034 0.0862 0.1032
Loa Loa (eye worm) oxidoreductase 0.0034 0.0862 0.0813
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0226 0.7228 1
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0076 0.2263 0.2263
Schistosoma mansoni aldo-keto reductase 0.0034 0.0862 0.0862
Schistosoma mansoni transcription factor LCR-F1 0.0226 0.7226 0.7226
Echinococcus multilocularis Kelch repeat type 1 0.0204 0.6514 0.6514
Trichomonas vaginalis aldo/keto reductase, putative 0.0034 0.0862 0.381
Echinococcus granulosus aldo keto reductase family 1, member B4 0.001 0.0053 0.0053
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0076 0.2263 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0898 0.0898
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0896 0.0896
Loa Loa (eye worm) hypothetical protein 0.0107 0.3289 0.3253
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Echinococcus multilocularis kelch ECH associated protein 1 0.0204 0.6495 0.6495
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0076 0.2263 0.6753
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Echinococcus granulosus cyclin dependent kinase 0.0053 0.1474 0.1474
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0397 0.0345
Onchocerca volvulus 0.0034 0.0862 0.9575
Brugia malayi hypothetical protein 0.0148 0.4643 0.5854
Schistosoma mansoni aldo-keto reductase 0.0034 0.0862 0.0862
Mycobacterium leprae Conserved hypothetical protein 0.0024 0.0532 0.5928
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0896 0.0896
Loa Loa (eye worm) hypothetical protein 0.0076 0.2263 0.2222
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.1474 0.1429
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.028 0.028
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.028 0.028
Schistosoma mansoni hypothetical protein 0.0015 0.0223 0.0223
Schistosoma mansoni potassium channel beta 0.001 0.0053 0.0053
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Echinococcus granulosus aldo keto reductase 0.0034 0.0862 0.0862
Echinococcus granulosus aldo keto reductase 0.0034 0.0862 0.0862
Brugia malayi Protein kinase domain containing protein 0.0108 0.3326 0.4174
Entamoeba histolytica protein kinase, putative 0.0108 0.3326 0.4563
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Loa Loa (eye worm) oxidoreductase 0.0034 0.0862 0.0813
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0034 0.0862 0.2472
Echinococcus multilocularis voltage gated potassium channel subunit 0.001 0.0053 0.0053
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Trichomonas vaginalis aldo/keto reductase, putative 0.0034 0.0862 0.381
Echinococcus multilocularis ubiquitin specific protease 41 0.0076 0.2263 0.2263
Loa Loa (eye worm) hypothetical protein 0.0035 0.0898 0.0849
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0898 0.2582
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0108 0.3326 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Brugia malayi cell division control protein 2 homolog 0.0053 0.1474 0.1813
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.1474 0.1429
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Loa Loa (eye worm) hypothetical protein 0.0042 0.1115 0.1067
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0034 0.0862 0.381
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0898 0.0898
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0898 0.3968
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0034 0.0862 0.1032
Schistosoma mansoni hypothetical protein 0.002 0.0397 0.0397
Onchocerca volvulus 0.0035 0.0898 1
Mycobacterium tuberculosis Conserved protein 0.0035 0.0898 0.1242
Brugia malayi Bromodomain containing protein 0.0074 0.217 0.27
Entamoeba histolytica aldose reductase, putative 0.0034 0.0862 0.1128
Loa Loa (eye worm) hypothetical protein 0.0148 0.4643 0.4614
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0034 0.0862 0.381
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Trichomonas vaginalis aldo-keto reductase, putative 0.001 0.0053 0.0235
Mycobacterium ulcerans beta-lactamase 0.0035 0.0898 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.028 0.028
Trichomonas vaginalis aldo/keto reductase, putative 0.0034 0.0862 0.381
Trichomonas vaginalis esterase, putative 0.0035 0.0898 0.3968
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0898 1
Echinococcus multilocularis geminin 0.0183 0.5815 0.5815
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0898 0.1242
Echinococcus granulosus kelch ECH associated protein 1 like 0.0204 0.6495 0.6495
Echinococcus granulosus hypothetical protein 0.0034 0.0862 0.0862
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.1474 0.1474
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.0108 0.3326 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0076 0.2263 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Brugia malayi follicle stimulating hormone receptor 0.0246 0.7894 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Plasmodium vivax protein kinase Crk2 0.0053 0.1474 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Leishmania major hypothetical protein, conserved 0.0035 0.0898 0.2582
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0034 0.0862 0.0862
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0053 0.1474 0.1474
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0076 0.2263 0.2263
Echinococcus granulosus kelch ECH associated protein 1 like 0.0204 0.6495 0.6495
Echinococcus granulosus aldehyde reductase 0.0024 0.0532 0.0532
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1474 0.6515
Loa Loa (eye worm) hypothetical protein 0.0038 0.0975 0.0927
Leishmania major aldo-keto reductase-like protein 0.0034 0.0862 0.2472
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0898 0.2582
Trichomonas vaginalis aldo-keto reductase, putative 0.0034 0.0862 0.381
Loa Loa (eye worm) hypothetical protein 0.004 0.1053 0.1005
Mycobacterium tuberculosis Conserved protein 0.0035 0.0898 0.1242
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.028 0.028
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0898 0.0849
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.1474 0.4343
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.1474 0.4343
Brugia malayi beta-lactamase 0.0035 0.0898 0.1078
Loa Loa (eye worm) hypothetical protein 0.0034 0.0862 0.0813
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0076 0.2263 0.6753
Trichomonas vaginalis conserved hypothetical protein 0.0076 0.2263 1
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0076 0.2263 0.2263
Trypanosoma cruzi aldo/keto reductase, putative 0.0034 0.0862 0.2472
Echinococcus multilocularis cyclin dependent kinase 0.0053 0.1474 0.1474
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.1474 0.1982
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1474 0.6515
Leishmania major prostaglandin f synthase, putative 0.0034 0.0862 0.2472
Echinococcus multilocularis zinc finger protein 0.0019 0.0362 0.0362
Mycobacterium ulcerans hypothetical protein 0.001 0.0053 0.0593
Trichomonas vaginalis alcohol dehydrogenase, putative 0.001 0.0053 0.0235
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0076 0.2263 0.3081
Entamoeba histolytica hypothetical protein 0.0226 0.7226 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0034 0.0862 0.0862
Mycobacterium ulcerans hypothetical protein 0.0035 0.0898 1
Schistosoma mansoni hypothetical protein 0.0226 0.7226 0.7226
Giardia lamblia Kinase, CMGC CDK 0.0053 0.1474 0.437
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0034 0.0862 0.1032
Schistosoma mansoni pol-related 0.0034 0.0862 0.0862
Echinococcus granulosus aldo keto reductase 0.0034 0.0862 0.0862
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0898 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) Inhibition of CDK1 ChEMBL. 23083119
IC50 (binding) > 10 uM Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting ChEMBL. 23083119
IC50 (binding) > 10 uM Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting ChEMBL. 23083119

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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