Detailed information for compound 306449

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 313.785 | Formula: C16H16ClN5
  • H donors: 0 H acceptors: 3 LogP: 3.47 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccccc1CN1CCCc2c1n1ncnc1nc2C
  • InChi: 1S/C16H16ClN5/c1-11-13-6-4-8-21(9-12-5-2-3-7-14(12)17)15(13)22-16(20-11)18-10-19-22/h2-3,5,7,10H,4,6,8-9H2,1H3
  • InChiKey: GQQJHSZQJQHSRN-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis CMGC family protein kinase 0.0094 0.0547 0.2266
Echinococcus multilocularis serine:threonine protein kinase N2 0.0109 0.0646 0.0646
Schistosoma mansoni diacylglycerol kinase theta 0.0053 0.0263 0.026
Loa Loa (eye worm) AGC/PDK1 protein kinase 0.0057 0.0288 0.1081
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0174 0.0206
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Loa Loa (eye worm) hypothetical protein 0.005 0.0245 0.0919
Loa Loa (eye worm) hypothetical protein 0.0345 0.228 0.8569
Loa Loa (eye worm) hypothetical protein 0.0363 0.2404 0.9036
Giardia lamblia Hypothetical protein 0.0173 0.1089 0.4072
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0185 0.076
Trichomonas vaginalis cyclin B, putative 0.0173 0.1089 0.4523
Schistosoma mansoni serine/threonine protein kinase 0.0518 0.3469 0.3467
Toxoplasma gondii ABC1 family protein 0.004 0.0174 0.0225
Trichomonas vaginalis cyclin A, putative 0.0042 0.0185 0.076
Loa Loa (eye worm) AGC/AKT protein kinase 0.0109 0.0646 0.2427
Toxoplasma gondii hypothetical protein 0.0131 0.0802 0.3445
Echinococcus multilocularis RNA directed DNA polymerase 0.0345 0.228 0.228
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0085 0.0342
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0045 0.0211 0.0211
Echinococcus multilocularis cyclin B3 1 0.0173 0.1089 0.1089
Entamoeba histolytica diacylglycerol kinase, putative 0.0053 0.0263 0.102
Loa Loa (eye worm) hypothetical protein 0.0038 0.0157 0.0589
Schistosoma mansoni serine/threonine protein kinase 0.0094 0.0547 0.0544
Brugia malayi p70 ribosomal S6 kinase beta 0.0109 0.0646 0.2333
Onchocerca volvulus 0.0042 0.0185 0.0049
Echinococcus granulosus protein kinase c epsilon type 0.0172 0.1087 0.1087
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0147 0.0599
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0174 0.0714
Entamoeba histolytica acyl-CoA synthetase, putative 0.005 0.0245 0.0945
Loa Loa (eye worm) hypothetical protein 0.0055 0.0278 0.1042
Echinococcus multilocularis cyclin t1 0.0042 0.0185 0.0185
Plasmodium falciparum cyclin dependent kinase binding protein, putative 0.0042 0.0185 0.0146
Schistosoma mansoni hypothetical protein 0.0053 0.0263 0.026
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Brugia malayi AMP-binding enzyme family protein 0.005 0.0245 0.0883
Schistosoma mansoni Cyclin fold protein 0.0042 0.0185 0.0183
Loa Loa (eye worm) hypothetical protein 0.0038 0.0157 0.0589
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.005 0.0245 0.067
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0174 0.0206
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0185 0.076
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0165 0.0675
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Echinococcus multilocularis cyclin y 0.0042 0.0185 0.0185
Loa Loa (eye worm) beta-lactamase 0.004 0.0174 0.0653
Schistosoma mansoni hypothetical protein 0.0042 0.0185 0.0183
Echinococcus granulosus cyclins 0.0173 0.1089 0.1089
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0094 0.0547 0.2054
Brugia malayi Protein kinase domain containing protein 0.0094 0.0547 0.1975
Trypanosoma brucei mitotic cyclin 6 0.0363 0.2404 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0045 0.0211 0.0866
Echinococcus granulosus 3-phosphoinositide-dependent protein kinase 1 0.0057 0.0288 0.0288
Trichomonas vaginalis CMGC family protein kinase 0.0094 0.0547 0.2266
Echinococcus multilocularis cyclin y 0.0042 0.0185 0.0185
Echinococcus multilocularis Rac GTPase activating protein 1 0.0053 0.0263 0.0263
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0211 0.0866
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0174 0.0653
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0021 0.0046 0.0179
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0265
Schistosoma mansoni cyclin B 0.0363 0.2404 0.2402
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0174 0.0714
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Toxoplasma gondii AGC kinase 0.0109 0.0646 0.2647
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0185 0.076
Echinococcus multilocularis G1:S specific cyclin D1 0.0042 0.0185 0.0185
Trichomonas vaginalis cyclin B3, putative 0.0042 0.0185 0.076
Echinococcus multilocularis Cyclin L1 0.0042 0.0185 0.0185
Mycobacterium ulcerans acyl-CoA synthetase 0.005 0.0245 1
Brugia malayi hypothetical protein 0.0042 0.0185 0.0668
Echinococcus granulosus RNA directed DNA polymerase 0.0345 0.228 0.228
Entamoeba histolytica diacylglycerol kinase, putative 0.0053 0.0263 0.102
Toxoplasma gondii diacylglycerol kinase, putative 0.0053 0.0263 0.068
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Schistosoma mansoni serine/threonine protein kinase 0.0172 0.1087 0.1085
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0064 0.0339 0.0339
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Schistosoma mansoni cyclin G2 0.0042 0.0185 0.0183
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Leishmania major hypothetical protein, conserved 0.004 0.0174 0.0714
Brugia malayi RhoGEF domain containing protein 0.0053 0.0263 0.0949
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.005 0.0245 1
Onchocerca volvulus 0.0053 0.0263 0.0398
Entamoeba histolytica cell division protein kinase 2, putative 0.0094 0.0547 0.2211
Entamoeba histolytica cyclin, domain containing protein 0.0042 0.0185 0.0694
Toxoplasma gondii cyclin 4, putative 0.0042 0.0185 0.0281
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0147 0.0599
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0053 0.0263 0.0987
Trypanosoma cruzi cdc2-related kinase 1 0.0094 0.0547 0.2266
Trichomonas vaginalis cyclin B, putative 0.0042 0.0185 0.076
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0045 0.0211 0.0866
Trypanosoma brucei cdc2-related kinase 1 0.0094 0.0547 0.2266
Schistosoma mansoni serine/threonine kinase 0.0109 0.0646 0.0643
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0109 0.0646 0.2427
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0174 0.0714
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0646 0.0643
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0288 0.1189
Brugia malayi beta-lactamase 0.004 0.0174 0.0628
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0045 0.0211 0.0866
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0174 0.1953
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0045 0.0211 0.0208
Trypanosoma cruzi cyclin 6, putative 0.0363 0.2404 1
Loa Loa (eye worm) cyclin C 0.0042 0.0185 0.0694
Brugia malayi C1-like domain containing protein 0.006 0.0309 0.1115
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Echinococcus granulosus serine:threonine protein kinase N2 0.0109 0.0646 0.0646
Echinococcus granulosus raf serine:threonine protein kinase 0.0054 0.0271 0.0271
Loa Loa (eye worm) cyclin domain-containing protein 0.0401 0.2661 1
Trichomonas vaginalis cyclin B3, putative 0.0173 0.1089 0.4523
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0174 0.0206
Echinococcus multilocularis protein kinase c epsilon type 0.0172 0.1087 0.1087
Entamoeba histolytica cyclin, putative 0.0363 0.2404 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0185 0.0694
Schistosoma mansoni cyclin G 0.0042 0.0185 0.0183
Schistosoma mansoni cyclin l 0.0042 0.0185 0.0183
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0316 0.2078 0.7811
Plasmodium vivax cyclin dependent kinase binding protein, putative 0.0042 0.0185 0.0146
Echinococcus granulosus cyclin G2 0.0042 0.0185 0.0185
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Schistosoma mansoni microtubule-associated protein tau 0.1465 1 1
Brugia malayi Protein kinase domain containing protein 0.0057 0.0288 0.104
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.005 0.0245 1
Echinococcus multilocularis microtubule associated protein 2 0.1465 1 1
Echinococcus multilocularis cyclin 0.0042 0.0185 0.0185
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0267
Loa Loa (eye worm) AGC/PDK1 protein kinase 0.0057 0.0288 0.1081
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0185 0.076
Echinococcus multilocularis cyclin dependent kinase 5 0.0094 0.0547 0.0547
Trypanosoma brucei cyclin 3 0.0042 0.0185 0.076
Trypanosoma cruzi target of rapamycin kinase 3 0.0036 0.0147 0.06
Entamoeba histolytica protein kinase, putative 0.0109 0.0646 0.2627
Echinococcus multilocularis raf serine:threonine protein kinase 0.0054 0.0271 0.0271
Loa Loa (eye worm) hypothetical protein 0.0042 0.0185 0.0694
Brugia malayi diacylglycerol kinase 0.0053 0.0263 0.0949
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0109 0.0646 0.0646
Echinococcus multilocularis serine:threonine protein kinase N2 0.0109 0.0646 0.0646
Trypanosoma cruzi cyclin, putative 0.0363 0.2404 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0265
Echinococcus multilocularis serine:threonine protein kinase 38 0.0109 0.0646 0.0646
Trypanosoma cruzi cyclin, putative 0.0363 0.2404 1
Echinococcus multilocularis cyclin k 0.0042 0.0185 0.0185
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0147 0.0599
Schistosoma mansoni serine/threonine protein kinase 0.0057 0.0288 0.0286
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0174 0.0172
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0109 0.0646 0.0646
Leishmania major mitotic cyclin, putative 0.0042 0.0185 0.076
Echinococcus granulosus Rac GTPase activating protein 1 0.0053 0.0263 0.0263
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Loa Loa (eye worm) CYL-1 protein 0.0042 0.0185 0.0694
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.006 0.0309 0.1115
Plasmodium falciparum glycogen synthase kinase 3 0.0316 0.2078 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0267
Loa Loa (eye worm) hypothetical protein 0.005 0.0245 0.0919
Echinococcus multilocularis cdk5 and abl1 enzyme substrate 1 0.0042 0.0185 0.0185
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Trichomonas vaginalis CMGC family protein kinase 0.0094 0.0547 0.2266
Trichomonas vaginalis cyclins, putative 0.0363 0.2404 1
Giardia lamblia Cyclin A 0.0173 0.1089 0.4072
Trichomonas vaginalis CMGC family protein kinase 0.0316 0.2078 0.8643
Trichomonas vaginalis cyclins, putative 0.0363 0.2404 1
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.028 0.1828 0.6869
Trichomonas vaginalis cyclin D, putative 0.0173 0.1089 0.4523
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Echinococcus granulosus cyclin B3 1 0.0173 0.1089 0.1089
Schistosoma mansoni vav2 0.0057 0.029 0.0287
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0288 0.1189
Echinococcus multilocularis protein kinase c eta type 0.0053 0.0263 0.0263
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0185 0.0146
Loa Loa (eye worm) RasGEF domain-containing protein 0.0053 0.0263 0.0987
Entamoeba histolytica protein kinase, putative 0.0109 0.0646 0.2627
Entamoeba histolytica protein kinase, putative 0.0109 0.0646 0.2627
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.006 0.0309 0.0309
Brugia malayi Cyclin, N-terminal domain containing protein 0.0363 0.2404 0.8689
Echinococcus granulosus G2:mitotic specific cyclin B3 0.0401 0.2661 0.2661
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0038 0.0157 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0267
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0174 0.0714
Echinococcus granulosus cyclins 0.0173 0.1089 0.1089
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Echinococcus granulosus protein kinase C gamma type 0.0465 0.3104 0.3104
Brugia malayi Variant SH3 domain containing protein 0.0057 0.029 0.1046
Echinococcus multilocularis oligomeric golgi complex subunit 3 0.0042 0.0185 0.0185
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.005 0.0245 1
Echinococcus multilocularis protein kinase c iota type 0.0161 0.1011 0.1011
Echinococcus granulosus cyclin G2 0.0042 0.0185 0.0185
Echinococcus multilocularis protein kinase shaggy 0.0316 0.2078 0.2078
Trypanosoma brucei rac serine-threonine kinase, putative 0.0109 0.0646 0.2679
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0288 0.1189
Echinococcus multilocularis cyclin A3 4 0.0042 0.0185 0.0185
Echinococcus granulosus cyclin dependent kinase 1 0.0094 0.0547 0.0547
Onchocerca volvulus Cyclin L homolog 0.0042 0.0185 0.0049
Entamoeba histolytica cell division protein kinase 2, putative 0.0094 0.0547 0.2211
Entamoeba histolytica protein kinase, putative 0.0057 0.0288 0.1126
Trypanosoma brucei cdc2-related kinase 3 0.0094 0.0547 0.2266
Toxoplasma gondii hypothetical protein 0.0042 0.0185 0.0281
Echinococcus multilocularis serine threonine protein kinase 0.0465 0.3104 0.3104
Onchocerca volvulus Protein CNPPD1 homolog 0.0042 0.0185 0.0049
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.005 0.0245 1
Loa Loa (eye worm) AGC/NDR protein kinase 0.0109 0.0646 0.2427
Schistosoma mansoni serine/threonine protein kinase 0.0054 0.0271 0.0268
Trypanosoma brucei mitotic cyclin 0.0042 0.0185 0.076
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0316 0.2078 0.8643
Entamoeba histolytica hypothetical protein 0.0042 0.0185 0.0694
Trichomonas vaginalis esterase, putative 0.004 0.0174 0.0714
Plasmodium vivax glycogen synthase kinase 3, putative 0.0316 0.2078 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0108 0.0437
Brugia malayi RhoGAP domain containing protein 0.0057 0.029 0.1046
Brugia malayi diacylglycerol kinase 0.0053 0.0263 0.0949
Brugia malayi cyclin fold protein 1 variant b 0.0042 0.0185 0.0668
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0045 0.0211 0.0801
Trypanosoma cruzi mitotic cyclin, putative 0.0042 0.0185 0.076
Loa Loa (eye worm) hypothetical protein 0.0191 0.1213 0.4559
Leishmania major 4-coumarate:coa ligase-like protein 0.005 0.0245 0.1008
Echinococcus granulosus cyclins 0.0042 0.0185 0.0185
Echinococcus granulosus Protein kinase C brain isozyme 0.0518 0.3469 0.3469
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Echinococcus granulosus cyclin B 0.0363 0.2404 0.2404
Brugia malayi Protein kinase domain containing protein 0.0109 0.0646 0.2333
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0045 0.0211 0.0866
Echinococcus granulosus cyclin dependent kinase 0.0094 0.0547 0.0547
Echinococcus multilocularis myotubularin protein 13 0.0053 0.0263 0.0263
Mycobacterium tuberculosis Conserved protein 0.004 0.0174 0.0206
Trichomonas vaginalis cyclin B, putative 0.0363 0.2404 1
Brugia malayi Ras association domain family 1 isoform A 0.0053 0.0263 0.0949
Trypanosoma cruzi cdc2-related kinase 3 0.0094 0.0547 0.2266
Loa Loa (eye worm) raf kinase 0.0053 0.0263 0.0987
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Mycobacterium ulcerans fatty-acid-CoA ligase 0.005 0.0245 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0015 0.0003 0.0008
Brugia malayi Protein kinase domain containing protein 0.006 0.0309 0.1115
Brugia malayi beta-lactamase family protein 0.004 0.0174 0.0628
Echinococcus granulosus cyclin k 0.0042 0.0185 0.0185
Entamoeba histolytica cyclin, domain containing protein 0.0042 0.0185 0.0694
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Echinococcus multilocularis cyclin dependent kinase 1 0.0094 0.0547 0.0547
Echinococcus granulosus N chimaerin 0.0057 0.029 0.029
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0036 0.0147 0.06
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0172 0.1087 0.4085
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0147 0.0599
Brugia malayi Pleckstrin Homology Domain 0.0053 0.0263 0.0949
Mycobacterium ulcerans acyl-CoA synthetase 0.005 0.0245 1
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0057 0.029 0.1088
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0038 0.0157 0.0093
Giardia lamblia G2/mitotic-specific cyclin B 0.0363 0.2404 1
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Echinococcus granulosus tyrosine protein kinase Lyn 0.0015 0.0005 0.0005
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0174 0.0206
Onchocerca volvulus 0.0064 0.0339 0.0738
Trypanosoma cruzi CYC2-like cyclin, putative 0.0363 0.2404 1
Loa Loa (eye worm) hypothetical protein 0.0398 0.2645 0.9942
Brugia malayi protein kinase C3,putative 0.006 0.0309 0.1115
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0109 0.0646 0.0646
Echinococcus multilocularis cyclin dependent kinase 0.0094 0.0547 0.0547
Echinococcus granulosus protein kinase c iota type 0.0161 0.1011 0.1011
Schistosoma mansoni diacylglycerol kinase theta 0.0053 0.0263 0.026
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0363 0.2402 0.9027
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0211 0.0866
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0174 0.0206
Loa Loa (eye worm) hypothetical protein 0.0363 0.2404 0.9036
Onchocerca volvulus 0.0053 0.0263 0.0398
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Trypanosoma brucei cyclin 9 0.0042 0.0185 0.076
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0518 0.3469 0.3469
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0211 0.079
Entamoeba histolytica cyclin, putative 0.0173 0.1089 0.4484
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0045 0.0211 0.0211
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0045 0.0211 0.0866
Brugia malayi intracellular kinase 0.0316 0.2078 0.751
Plasmodium vivax hypothetical protein, conserved 0.004 0.0174 0.0089
Giardia lamblia Kinase, CMGC CDK 0.0094 0.0547 0.163
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0094 0.0547 0.2054
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0646 0.0643
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0174 0.0714
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.005 0.0245 1
Trichomonas vaginalis cyclins, putative 0.0363 0.2404 1
Schistosoma mansoni protein kinase C mu 0.0053 0.0263 0.026
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Trichomonas vaginalis cyclin B, putative 0.0363 0.2404 1
Brugia malayi phosphoinositide-dependent protein kinase I 0.0057 0.0288 0.104
Toxoplasma gondii cyclin dependent kinase binding protein 0.0042 0.0185 0.0281
Schistosoma mansoni unc-13 (munc13) 0.0064 0.0339 0.0336
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Entamoeba histolytica protein kinase, putative 0.0109 0.0646 0.2627
Trichomonas vaginalis cyclin A, putative 0.0363 0.2404 1
Leishmania major cyclin 9, putative 0.0042 0.0185 0.076
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0109 0.0646 0.2427
Echinococcus granulosus unc 13 munc13 0.0064 0.0339 0.0339
Brugia malayi Hr1 repeat family protein 0.0109 0.0646 0.2333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0085 0.0342
Loa Loa (eye worm) cyclin fold protein 1 variant b 0.0042 0.0185 0.0694
Echinococcus granulosus oligomeric golgi complex subunit 3 0.0042 0.0185 0.0185
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Mycobacterium ulcerans hypothetical protein 0.004 0.0174 0.1953
Loa Loa (eye worm) hypothetical protein 0.0038 0.0157 0.0589
Schistosoma mansoni g1/s-specific cyclin C 0.0042 0.0185 0.0183
Giardia lamblia Kinase, CMGC GSK 0.0316 0.2078 0.8531
Schistosoma mansoni serine/threonine protein kinase 0.0094 0.0547 0.0544
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.0815 0.306
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0057 0.029 0.0287
Giardia lamblia Kinase, CMGC GSK 0.0316 0.2078 0.8531
Mycobacterium ulcerans acyl-CoA synthetase 0.005 0.0245 1
Toxoplasma gondii cyclin, N-terminal domain-containing protein 0.0042 0.0185 0.0281
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0174 0.0206
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Trichomonas vaginalis cyclin B, putative 0.0042 0.0185 0.076
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0316 0.2078 0.2076
Brugia malayi Cyclin, N-terminal domain containing protein 0.0363 0.2404 0.8689
Echinococcus granulosus cyclin A3 4 0.0042 0.0185 0.0185
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0045 0.0211 0.0866
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Entamoeba histolytica cyclin family protein 0.0173 0.1089 0.4484
Schistosoma mansoni proteasome subunit alpha 1 (T01 family) 0.0042 0.0185 0.0183
Schistosoma mansoni serine/threonine protein kinase 0.0518 0.3469 0.3467
Echinococcus multilocularis cyclin G2 0.0042 0.0185 0.0185
Onchocerca volvulus 0.005 0.0245 0.0317
Trypanosoma cruzi cdc2-related kinase 3 0.0094 0.0547 0.2266
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0174 0.0172
Entamoeba histolytica hypothetical protein 0.0053 0.0263 0.102
Entamoeba histolytica cyclin family protein 0.0173 0.1089 0.4484
Echinococcus granulosus cyclin y 0.0042 0.0185 0.0185
Brugia malayi AMP-binding enzyme family protein 0.005 0.0245 0.0883
Loa Loa (eye worm) hypothetical protein 0.0087 0.0501 0.1881
Brugia malayi Cyclin, N-terminal domain containing protein 0.0042 0.0185 0.0668
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.028 0.1828 0.1828
Trichomonas vaginalis cyclin D, putative 0.0042 0.0185 0.076
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Trichomonas vaginalis cyclin B, putative 0.0363 0.2404 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0211 0.0759
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0101 0.0409
Brugia malayi cell division control protein 2 homolog 0.0094 0.0547 0.1975
Plasmodium vivax protein kinase Crk2 0.0094 0.0547 0.2028
Loa Loa (eye worm) hypothetical protein 0.0038 0.0157 0.0589
Brugia malayi RhoGAP domain containing protein 0.0053 0.0263 0.0949
Brugia malayi MH2 domain containing protein 0.0133 0.0815 0.2943
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Schistosoma mansoni cyclin B3 0.0401 0.2661 0.2658
Schistosoma mansoni atypical protein kinase C 0.0161 0.1011 0.1009
Leishmania major rac serine-threonine kinase, putative,protein kinase, putative 0.0178 0.1126 0.4675
Echinococcus granulosus G1:S specific cyclin D1 0.0042 0.0185 0.0185
Brugia malayi beta-lactamase family protein 0.004 0.0174 0.0628
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0147 0.0599
Trichomonas vaginalis cyclin B3, putative 0.0042 0.0185 0.076
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0094 0.0547 0.2054
Leishmania major mitotic cyclin, putative 0.0042 0.0185 0.076
Brugia malayi AMP-binding enzyme family protein 0.005 0.0245 0.0883
Plasmodium falciparum cyclin 1 0.0042 0.0185 0.0146
Schistosoma mansoni hypothetical protein 0.0042 0.0185 0.0183
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0174 0.0714
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Loa Loa (eye worm) cyclin domain-containing protein 0.0042 0.0185 0.0694
Loa Loa (eye worm) AGC/PKN protein kinase 0.0109 0.0646 0.2427
Leishmania major cyclin 0.0363 0.2404 1
Echinococcus granulosus cyclin t1 0.0042 0.0185 0.0185
Plasmodium vivax cyclin homologue, putative 0.0042 0.0185 0.0146
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0316 0.2078 0.2078
Trichomonas vaginalis cyclins, putative 0.0173 0.1089 0.4523
Schistosoma mansoni protein kinase C 0.0064 0.0339 0.0336
Brugia malayi hypothetical protein 0.0042 0.0185 0.0668
Brugia malayi Protein kinase domain containing protein 0.0109 0.0646 0.2333
Echinococcus granulosus Cyclin L1 0.0042 0.0185 0.0185
Trichomonas vaginalis cyclins, putative 0.0232 0.1501 0.6237
Trichomonas vaginalis cyclin D, putative 0.0173 0.1089 0.4523
Trypanosoma cruzi cyclin 9, putative 0.0042 0.0185 0.076
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0094 0.0547 0.2138
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0174 0.0714
Brugia malayi Cyclin C 0.0042 0.0185 0.0668
Echinococcus granulosus protein kinase c eta type 0.0053 0.0263 0.0263
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0109 0.0646 0.0646
Brugia malayi Protein kinase domain containing protein 0.0109 0.0646 0.2333
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0102 0.06 0.2487
Loa Loa (eye worm) hypothetical protein 0.0038 0.0157 0.0589
Echinococcus granulosus cyclin y 0.0042 0.0185 0.0185
Schistosoma mansoni rac gtpase activating protein 0.0053 0.0263 0.026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0083 0.0334
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0174 0.0206
Echinococcus multilocularis cyclin dependent kinase 1 0.0094 0.0547 0.0547
Echinococcus granulosus NDR protein kinase 0.0109 0.0646 0.0646
Mycobacterium ulcerans lipase LipD 0.004 0.0174 0.1953
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0042 0.0185 0.0146
Giardia lamblia GTOR 0.0045 0.0211 0.0114
Schistosoma mansoni unc-13 (munc13) 0.0064 0.0339 0.0336
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0316 0.2078 1
Trichomonas vaginalis cyclins, putative 0.0042 0.0185 0.076
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Plasmodium vivax cyclin 4, putative 0.0042 0.0185 0.0146
Brugia malayi ribosomal protein S6 kinase alpha 3 0.0178 0.1126 0.4067
Echinococcus multilocularis N chimaerin 0.0057 0.029 0.029
Echinococcus granulosus cdk5 and abl1 enzyme substrate 1 0.0042 0.0185 0.0185
Echinococcus granulosus cyclin b3 0.0173 0.1089 0.1089
Onchocerca volvulus 0.0055 0.0278 0.0463
Schistosoma mansoni serine/threonine protein kinase 0.006 0.0309 0.0306
Schistosoma mansoni cyclin d 0.0042 0.0185 0.0183
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.0815 0.306
Leishmania major 4-coumarate:coa ligase-like protein 0.005 0.0245 0.1008
Trichomonas vaginalis cyclins, putative 0.0042 0.0185 0.076
Entamoeba histolytica acyl-CoA synthetase, putative 0.005 0.0245 0.0945
Trichomonas vaginalis cyclin B, putative 0.0363 0.2404 1
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0094 0.0547 0.2266
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0653
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0053 0.0263 0.0987
Echinococcus granulosus protein kinase shaggy 0.0316 0.2078 0.2078
Trichomonas vaginalis cyclins, putative 0.0363 0.2404 1
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0064 0.0339 0.0339
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0256 0.1664 1
Echinococcus granulosus Diacylglycerol kinase theta 0.0053 0.0263 0.0263
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.006 0.0309 0.0309
Schistosoma mansoni cyclin k 0.0042 0.0185 0.0183
Plasmodium falciparum protein kinase 5 0.0094 0.0547 0.2028
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0036 0.0147 0.06
Onchocerca volvulus Cyclin L homolog 0.0042 0.0185 0.0049
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0174 0.1953
Brugia malayi protein kinase C II. 0.0172 0.1087 0.3927
Leishmania major CYC2-like cyclin, putative,cyclin 6, putative 0.0363 0.2404 1
Trypanosoma brucei cyclin dependent kinase-binding protein, putative 0.0042 0.0185 0.076
Echinococcus multilocularis unc 13 (munc13) 0.0064 0.0339 0.0339
Mycobacterium ulcerans hypothetical protein 0.005 0.0245 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0085 0.0342
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0094 0.0547 0.2266
Entamoeba histolytica protein kinase, putative 0.0316 0.2078 0.8633
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0083 0.0334
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0174 0.0174
Entamoeba histolytica protein kinase domain containing protein 0.0316 0.2078 0.8633
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Entamoeba histolytica protein kinase domain containing protein 0.0316 0.2078 0.8633
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0094 0.0547 0.0547
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0015 0.0003 0.0008
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0057 0.029 0.029
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0015 0.0003 0.0003
Onchocerca volvulus 0.0363 0.2404 1
Echinococcus multilocularis Diacylglycerol kinase theta 0.0053 0.0263 0.0263
Trypanosoma brucei protein kinase, putative 0.0316 0.2078 0.8643
Schistosoma mansoni cellular tumor antigen P53 0.0055 0.0278 0.0275
Entamoeba histolytica cyclin C, putative 0.0042 0.0185 0.0694
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Echinococcus multilocularis G2:mitotic specific cyclin B3 0.0401 0.2661 0.2661
Echinococcus multilocularis cyclins 0.0173 0.1089 0.1089
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Entamoeba histolytica acyl-coA synthetase, putative 0.005 0.0245 0.0945
Echinococcus granulosus myotubularin protein 13 0.0053 0.0263 0.0263
Schistosoma mansoni serine/threonine protein kinase 0.028 0.1828 0.1825
Giardia lamblia Kinase, AGC AKT 0.0178 0.1126 0.4237
Giardia lamblia Kinase, CMGC CDK 0.0094 0.0547 0.163
Loa Loa (eye worm) hypothetical protein 0.005 0.0245 0.0919
Loa Loa (eye worm) hypothetical protein 0.0109 0.0646 0.2427
Trypanosoma cruzi cdc2-related kinase 1 0.0094 0.0547 0.2266
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0185 0.076
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0057 0.029 0.0287
Loa Loa (eye worm) hypothetical protein 0.0064 0.0339 0.1272
Echinococcus granulosus tumor protein p63 0.0376 0.2493 0.2493
Onchocerca volvulus 0.0316 0.2078 0.8538
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0045 0.0211 0.0801
Mycobacterium tuberculosis Conserved protein 0.004 0.0174 0.0206
Mycobacterium tuberculosis Conserved protein 0.004 0.0174 0.0206
Echinococcus granulosus cyclins 0.0173 0.1089 0.1089
Mycobacterium ulcerans beta-lactamase 0.004 0.0174 0.1953
Echinococcus multilocularis cyclin G2 0.0042 0.0185 0.0185
Echinococcus granulosus cyclins 0.0173 0.1089 0.1089
Schistosoma mansoni serine/threonine protein kinase 0.006 0.0309 0.0306
Brugia malayi Cyclin, N-terminal domain containing protein 0.0401 0.2661 0.9615
Plasmodium falciparum cyclin 0.0173 0.1089 0.485
Schistosoma mansoni protein kinase C mu 0.006 0.0309 0.0306
Echinococcus granulosus cyclins 0.0173 0.1089 0.1089
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0316 0.2078 0.8643
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0267
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0646 0.0643
Trypanosoma cruzi mitotic cyclin, putative 0.0042 0.0185 0.076
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0174 0.0174
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.028 0.1828 0.1828
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0211 0.0866
Echinococcus multilocularis 3 phosphoinositide dependent protein kinase 1 0.0057 0.0288 0.0288
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0316 0.2078 0.2078
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0057 0.029 0.029
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.005 0.0245 0.067
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0316 0.2078 0.7811
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0109 0.0646 0.2427
Echinococcus granulosus cyclin 0.0042 0.0185 0.0185
Echinococcus multilocularis tumor protein p63 0.0376 0.2493 0.2493
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0067 0.0265
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.006 0.0309 0.1159
Trichomonas vaginalis AGC family protein kinase 0.0109 0.0646 0.2679
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0019 0.0028 0.0104
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0345 0.228 0.228
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0174 0.0714
Loa Loa (eye worm) hypothetical protein 0.0053 0.0263 0.0987
Echinococcus granulosus cyclin dependent kinase 5 0.0094 0.0547 0.0547
Echinococcus multilocularis cyclin b3 0.0173 0.1089 0.1089
Trichomonas vaginalis CMGC family protein kinase 0.0316 0.2078 0.8643
Schistosoma mansoni cyclins 0.0173 0.1089 0.1086
Trichomonas vaginalis conserved hypothetical protein 0.0173 0.1089 0.4523
Loa Loa (eye worm) CAMK/PKD protein kinase 0.006 0.0309 0.1159
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0131 0.0532
Leishmania major 4-coumarate:coa ligase-like protein 0.005 0.0245 0.1008
Echinococcus multilocularis cyclin B 0.0363 0.2404 0.2404
Toxoplasma gondii cyclin domain protein, cyclin H family protein 0.0042 0.0185 0.0281
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0015 0.0003 0.0003
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0174 0.0628
Brugia malayi Protein kinase c protein 2 0.0416 0.2767 1

Activities

Activity type Activity value Assay description Source Reference
HI (functional) = 10 Hypotensive index (HI) measured as the area under the time-hypotensive response curve for 6-h period at 30mg/kg,po ChEMBL. 7401118
IVP (functional) e 0 Integrated vasodilating potency (the product of compound-induced maximum percent decrease in the perfusion pressure and the duration of the effect in minutes at 100 ug (ia); Coronary vasoconstricting action) ChEMBL. 7401118

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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