Detailed information for compound 165886

Basic information

Technical information
  • TDR Targets ID: 165886
  • Name: 1-[4-[[4-(2-chloroanilino)pyrimidin-2-yl]amin o]phenoxy]-3-(dimethylamino)propan-2-ol
  • MW: 413.901 | Formula: C21H24ClN5O2
  • H donors: 3 H acceptors: 3 LogP: 3.97 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(CC(COc1ccc(cc1)Nc1nccc(n1)Nc1ccccc1Cl)O)C
  • InChi: 1S/C21H24ClN5O2/c1-27(2)13-16(28)14-29-17-9-7-15(8-10-17)24-21-23-12-11-20(26-21)25-19-6-4-3-5-18(19)22/h3-12,16,28H,13-14H2,1-2H3,(H2,23,24,25,26)
  • InChiKey: DIWXPXNCGSGMLS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[4-[[4-(2-chloroanilino)-2-pyrimidinyl]amino]phenoxy]-3-(dimethylamino)-2-propanol
  • 1-[4-[[4-[(2-chlorophenyl)amino]pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol
  • 1-[4-[[4-[(2-chlorophenyl)amino]pyrimidin-2-yl]amino]phenoxy]-3-dimethylaminopropan-2-ol
  • 1-[4-[[4-[(2-chlorophenyl)amino]pyrimidin-2-yl]amino]phenoxy]-3-dimethylamino-propan-2-ol
  • 1-[4-[[4-[(2-chlorophenyl)amino]-2-pyrimidinyl]amino]phenoxy]-3-dimethylaminopropan-2-ol
  • 2,4-bis anilino pyrimidine deriv. 3

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cyclin-dependent kinase 3 Starlite/ChEMBL References
Homo sapiens cyclin-dependent kinase 4 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus cyclin dependent kinase 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
Leishmania mexicana cell division protein kinase 2,cdc2-related kinase 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 granulosus cyclin dependent kinase 1 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
Schistosoma mansoni serine/threonine protein kinase 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
Echinococcus multilocularis cyclin dependent kinase 1 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
Brugia malayi Protein kinase domain containing protein 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 hominis cdc2-like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania mexicana cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei cdc2-related kinase 3 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
Trypanosoma brucei gambiense cell division related protein kinase 2, putative,CDC2-related protein kinase 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 falciparum protein kinase 5 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
Trypanosoma cruzi cdc2-related kinase 1 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 cdc2-related kinase 3 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
Plasmodium berghei cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cell division protein kinase 2 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
Leishmania infantum cell division related protein kinase 2,cdc2-related 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
Plasmodium yoelii cdc2-related kinase 2 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
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Toxoplasma gondii cell-cycle-associated protein kinase CDK, 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
Leishmania braziliensis cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania braziliensis cell division protein kinase 2,cdc2-related 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
Plasmodium vivax protein kinase Crk2 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania major cell division protein kinase 2,cdc2-related kinase 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 cruzi cdc2-related 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
Schistosoma japonicum ko:K02087 cyclin-dependent kinase 1, putative 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
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_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
Entamoeba histolytica cell division protein kinase 2, putative 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
Leishmania major cell division related protein kinase 2,cdc2-related 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
Trichomonas vaginalis CMGC family protein kinase 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
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium knowlesi Cell division control protein 2 homolog 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
Trypanosoma brucei cdc2-related kinase 1 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
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 4 303 aa 312 aa 29.8 %
Trypanosoma brucei mitogen-activated protein kinase 5 cyclin-dependent kinase 3 305 aa 303 aa 32.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis lamin dm0 0.0028 0.004 0.004
Echinococcus granulosus lamin 0.0028 0.004 0.004
Echinococcus multilocularis cyclin dependent kinase 0.0053 0.039 0.039
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Echinococcus multilocularis lamin 0.0028 0.004 0.004
Schistosoma mansoni hypothetical protein 0.0177 0.218 0.218
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0669 0.1077
Loa Loa (eye worm) hypothetical protein 0.0029 0.0057 0.0095
Schistosoma mansoni hypothetical protein 0.0036 0.0147 0.0147
Loa Loa (eye worm) intermediate filament protein 0.0028 0.004 0.0066
Schistosoma mansoni lamin 0.0028 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Onchocerca volvulus 0.0072 0.0669 0.1117
Mycobacterium leprae Probable lipase LipE 0.0072 0.0669 0.3528
Echinococcus granulosus peregrin 0.0029 0.0057 0.0057
Schistosoma mansoni sodium/chloride dependent transporter 0.0027 0.0016 0.0016
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0669 0.1371
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.004 0.0066
Brugia malayi jmjC domain containing protein 0.0036 0.0146 0.0243
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.015 0.1786 0.1786
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Trichomonas vaginalis esterase, putative 0.0072 0.0669 0.1371
Trypanosoma brucei C-8 sterol isomerase, putative 0.0365 0.4877 1
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.039 0.039
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0274 0.0457
Brugia malayi PHD-finger family protein 0.0029 0.0057 0.0095
Loa Loa (eye worm) hypothetical protein 0.0052 0.0374 0.0624
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0295 0.3867 1
Echinococcus granulosus lamin dm0 0.0028 0.004 0.004
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.039 0.0486
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.039 0.0486
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0037 0.0161 0.2407
Echinococcus multilocularis microtubule associated protein 2 0.0723 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0669 0.1371
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0443 0.5992 1
Loa Loa (eye worm) hypothetical protein 0.0248 0.3187 0.5318
Loa Loa (eye worm) jmjC domain-containing protein 0.0036 0.0146 0.0243
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Loa Loa (eye worm) hypothetical protein 0.0028 0.0032 0.0054
Loa Loa (eye worm) hypothetical protein 0.0187 0.2314 0.3862
Mycobacterium ulcerans hypothetical protein 0.0072 0.0669 0.3297
Echinococcus granulosus cyclin dependent kinase 5 0.0053 0.039 0.039
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0144 0.1702 0.2601
Echinococcus granulosus lysine specific demethylase 5A 0.0036 0.0146 0.0146
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0053 0.039 0.0651
Plasmodium falciparum phd finger protein, putative 0.0029 0.0057 0.1461
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0274 0.0274
Plasmodium falciparum protein kinase 5 0.0053 0.039 1
Mycobacterium ulcerans esterase/lipase LipP 0.0072 0.0669 0.3297
Brugia malayi Sodium:neurotransmitter symporter family protein 0.015 0.1786 0.2981
Brugia malayi vesicular acetylcholine transporter unc-17 0.0443 0.5992 1
Echinococcus multilocularis musashi 0.0028 0.004 0.004
Echinococcus granulosus survival motor neuron protein 1 0.0248 0.3187 0.3187
Leishmania major hypothetical protein, conserved 0.0072 0.0669 0.1077
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0222 0.0222
Mycobacterium tuberculosis Conserved protein 0.0072 0.0669 0.0918
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0144 0.1702 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.004 0.0066
Echinococcus multilocularis vesicular acetylcholine transporter 0.0443 0.5992 0.5992
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0072 0.0669 0.0918
Brugia malayi ERG2 and Sigma1 receptor like protein 0.0365 0.4877 0.8139
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0669 0.0669
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0096 0.1018 0.1018
Brugia malayi intermediate filament protein 0.0028 0.004 0.0066
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.039 0.039
Loa Loa (eye worm) norepinephrine transporter 0.015 0.1786 0.2981
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0096 0.1018 0.1018
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.039 0.0651
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.039 0.0618
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.0161 0.0161
Onchocerca volvulus Alhambra homolog 0.0029 0.0057 0.0095
Schistosoma mansoni inositol monophosphatase 0.0037 0.0161 0.0161
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0274 0.0457
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Schistosoma mansoni intermediate filament proteins 0.0028 0.004 0.004
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0147 0.0245
Loa Loa (eye worm) solute carrier family 6 member 4 0.015 0.1786 0.2981
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0384 0.064
Mycobacterium ulcerans beta-lactamase 0.0072 0.0669 0.3297
Mycobacterium leprae conserved hypothetical protein 0.0072 0.0669 0.3528
Echinococcus multilocularis serotonin transporter 0.015 0.1786 0.1786
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Mycobacterium tuberculosis Probable esterase LipL 0.0072 0.0669 0.0918
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0051 0.0359 0.0599
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.039 0.0651
Schistosoma mansoni vesicular acetylcholine transporter 0.0443 0.5992 0.5992
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0057 0.0095
Loa Loa (eye worm) hypothetical protein 0.015 0.1786 0.2981
Onchocerca volvulus 0.015 0.1786 0.2981
Schistosoma mansoni survival motor neuron protein 0.0051 0.0359 0.0359
Mycobacterium tuberculosis Probable lipase LipD 0.0072 0.0669 0.0918
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.004 0.0066
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Loa Loa (eye worm) hypothetical protein 0.0052 0.0384 0.064
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0295 0.3867 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0072 0.0669 0.1117
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0057 0.0057
Treponema pallidum fructose-bisphosphate aldolase 0.0295 0.3867 1
Leishmania major C-8 sterol isomerase-like protein 0.0365 0.4877 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0147 0.0245
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.039 0.0618
Loa Loa (eye worm) hypothetical protein 0.015 0.1786 0.2981
Schistosoma mansoni sodium/chloride dependent transporter 0.015 0.1786 0.1786
Onchocerca volvulus 0.0028 0.004 0.0066
Plasmodium vivax protein kinase Crk2 0.0053 0.039 0.583
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0057 0.0852
Onchocerca volvulus 0.0072 0.0669 0.1117
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0669 0.1371
Schistosoma mansoni microtubule-associated protein tau 0.0723 1 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0461 0.6244 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0669 0.1371
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.039 0.0486
Schistosoma mansoni hypothetical protein 0.0029 0.0057 0.0057
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.0146 0.0146
Loa Loa (eye worm) hypothetical protein 0.015 0.1786 0.2981
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.039 0.039
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Loa Loa (eye worm) inositol-1 0.0037 0.0161 0.0269
Loa Loa (eye worm) serotonin transporter b 0.015 0.1786 0.2981
Giardia lamblia Fructose-bisphosphate aldolase 0.0295 0.3867 1
Echinococcus multilocularis geminin 0.0177 0.218 0.218
Mycobacterium tuberculosis Conserved protein 0.0072 0.0669 0.0918
Mycobacterium tuberculosis Probable hydrolase 0.0072 0.0669 0.0918
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Trypanosoma brucei hypothetical protein, conserved 0.0072 0.0669 0.1077
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0274 0.0274
Schistosoma mansoni inositol monophosphatase 0.0037 0.0161 0.0161
Brugia malayi beta-lactamase 0.0072 0.0669 0.1117
Schistosoma mansoni hypothetical protein 0.0051 0.0359 0.0359
Schistosoma mansoni hypothetical protein 0.0177 0.218 0.218
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.039 0.0618
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0053 0.039 0.0486
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0669 0.1371
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0384 0.064
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0053 0.039 0.039
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0443 0.5992 1
Mycobacterium tuberculosis Conserved protein 0.0072 0.0669 0.0918
Loa Loa (eye worm) hypothetical protein 0.0365 0.4877 0.8139
Trypanosoma brucei cdc2-related kinase 3 0.0053 0.039 0.0486
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0025 0 0.5
Echinococcus granulosus vesicular acetylcholine transporter 0.0443 0.5992 0.5992
Plasmodium vivax hypothetical protein, conserved 0.0072 0.0669 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0669 0.1117
Schistosoma mansoni lamin 0.0028 0.004 0.004
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0057 0.0057
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0146 0.0146
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0274 0.0274
Loa Loa (eye worm) beta-lactamase 0.0072 0.0669 0.1117
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0274 0.0274
Trypanosoma brucei cdc2-related kinase 1 0.0053 0.039 0.0486
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0072 0.0669 0.3297
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0222 0.0222
Brugia malayi hypothetical protein 0.0248 0.3187 0.5318
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0669 0.0669
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0365 0.4877 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0274 0.0274
Brugia malayi jmjC domain containing protein 0.0096 0.1018 0.1698
Brugia malayi Inositol-1 0.0037 0.0161 0.0269
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0274 0.0274
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.039 0.0618
Echinococcus granulosus intermediate filament protein 0.0028 0.004 0.004
Echinococcus multilocularis survival motor neuron protein 1 0.0248 0.3187 0.3187
Schistosoma mansoni jumonji domain containing protein 0.0077 0.0733 0.0733
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0057 0.0852
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0072 0.0669 0.0918
Echinococcus multilocularis peregrin 0.0029 0.0057 0.0057
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0072 0.0669 0.0918
Onchocerca volvulus 0.0072 0.0669 0.1117
Giardia lamblia Kinase, CMGC CDK 0.0053 0.039 0.0874
Echinococcus granulosus serotonin transporter 0.015 0.1786 0.1786
Brugia malayi Protein kinase domain containing protein 0.0053 0.039 0.0651
Loa Loa (eye worm) hypothetical protein 0.005 0.0359 0.0598
Mycobacterium ulcerans lipase LipD 0.0072 0.0669 0.3297
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.0507 0.0845
Echinococcus granulosus geminin 0.0177 0.218 0.218
Brugia malayi beta-lactamase family protein 0.0072 0.0669 0.1117
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0274 0.0274
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0295 0.3867 1
Echinococcus granulosus cyclin dependent kinase 0.0053 0.039 0.039
Echinococcus multilocularis beta LACTamase domain containing family member 0.0072 0.0669 0.0669
Mycobacterium tuberculosis Probable lipase LipE 0.0072 0.0669 0.0918
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0146 0.0146
Onchocerca volvulus 0.0028 0.004 0.0066
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0053 0.039 0.583
Brugia malayi cell division control protein 2 homolog 0.0053 0.039 0.0651
Echinococcus granulosus cyclin dependent kinase 1 0.0053 0.039 0.039
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.0161 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0669 0.1077
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0384 0.064
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.039 0.039
Giardia lamblia Kinase, CMGC CDK 0.0053 0.039 0.0874
Brugia malayi beta-lactamase family protein 0.0072 0.0669 0.1117
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.0161 0.0161
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0072 0.0669 0.1117
Echinococcus granulosus beta LACTamase domain containing family member 0.0072 0.0669 0.0669
Echinococcus multilocularis cyclin dependent kinase 5 0.0053 0.039 0.039
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.039 0.0486
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0053 0.039 0.0486
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.039 0.0618
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0057 0.0852
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0057 0.0057
Toxoplasma gondii ABC1 family protein 0.0072 0.0669 1
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0144 0.1702 1
Brugia malayi Bromodomain containing protein 0.0029 0.0057 0.0095
Onchocerca volvulus 0.0051 0.0359 0.0599

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 1 uM Inhibitory concentration against cyclin-dependent kinase 4 ChEMBL. 12941312
IC50 (binding) = 1 uM Inhibitory concentration against cyclin-dependent kinase 4 ChEMBL. 12941312
IC50 (binding) = 6 uM Inhibitory concentration against cyclin-dependent kinase 2 ChEMBL. 12941312
IC50 (binding) = 6 uM Inhibitory concentration against cyclin-dependent kinase 2 ChEMBL. 12941312

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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