Detailed information for compound 1051529

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 223.143 | Formula: C9H16Cl2N2
  • H donors: 2 H acceptors: 0 LogP: 3.28 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCNc1ccccc1CN.Cl.Cl
  • InChi: 1S/C9H14N2.2ClH/c1-2-11-9-6-4-3-5-8(9)7-10;;/h3-6,11H,2,7,10H2,1H3;2*1H
  • InChiKey: WNZJIZYJNVGMDC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0037 0.0128 0.0128
Trichomonas vaginalis DNA polymerase eta, putative 0.006 0.0272 0.1034
Loa Loa (eye worm) hypothetical protein 0.0073 0.036 0.061
Leishmania major importin beta-1 subunit, putative 0.0027 0.0062 0.011
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0029 0.0073 0.013
Echinococcus granulosus tyrosine protein kinase Fyn 0.0037 0.0128 0.0212
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0061 0.0281 0.0497
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0127 0.0224
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Echinococcus multilocularis Polycystic kidney disease protein 0.002 0.0016 0.0016
Trichomonas vaginalis ran, putative 0.0024 0.0046 0.0175
Echinococcus granulosus tyrosine protein kinase Src42A 0.0037 0.0128 0.0212
Trypanosoma cruzi DNA polymerase eta, putative 0.0033 0.0101 0.0179
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Brugia malayi RNA, U transporter 1 0.0095 0.0499 0.0881
Echinococcus granulosus tyrosine protein kinase Blk 0.0034 0.0105 0.0173
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0069 0.0334 0.059
Plasmodium vivax acyl-CoA synthetase, putative 0.0073 0.036 0.0636
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0217 0.1288 0.213
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Toxoplasma gondii thioredoxin reductase 0.005 0.0211 0.0374
Loa Loa (eye worm) oxidoreductase 0.0029 0.0073 0.0102
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0153 0.027
Trypanosoma brucei protein kinase, putative 0.0054 0.0237 0.0418
Toxoplasma gondii propionate-CoA ligase 0.0029 0.0073 0.013
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0054 0.0237 0.0418
Entamoeba histolytica acyl-CoA synthetase, putative 0.0098 0.0519 1
Toxoplasma gondii ABC1 family protein 0.0079 0.0398 0.0703
Schistosoma mansoni importin beta-1 0.0033 0.0103 0.0181
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0033 0.0101 0.0152
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0217 0.1288 0.1288
Mycobacterium tuberculosis Probable reductase 0.0114 0.0626 0.1106
Schistosoma mansoni sex comb on midleg homolog 0.0055 0.0243 0.043
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0138 0.0779 0.1377
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0077 0.0137
Echinococcus multilocularis histone acetyltransferase MYST2 0.0063 0.0292 0.0292
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0127 0.0708 0.1252
Plasmodium vivax multidomain scavenger receptor, putative 0.002 0.0016 0.0027
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0079 0.0398 0.0703
Loa Loa (eye worm) hypothetical protein 0.0029 0.0073 0.0102
Entamoeba histolytica hypothetical protein 0.0027 0.0062 0.034
Schistosoma mansoni inositol monophosphatase 0.0037 0.0127 0.0224
Onchocerca volvulus 0.0098 0.0519 0.0893
Giardia lamblia DINP protein human, muc B family 0.004 0.0144 0.6074
Trichomonas vaginalis antibiotic synthetase, putative 0.0029 0.0073 0.0278
Plasmodium vivax importin-beta 2, putative 0.0033 0.0103 0.0181
Leishmania major 4-coumarate:coa ligase-like protein 0.0098 0.0519 0.0918
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0029 0.0073 0.0102
Trypanosoma brucei unspecified product 0.0053 0.023 0.0406
Echinococcus multilocularis beta LACTamase domain containing family member 0.0079 0.0398 0.0398
Echinococcus multilocularis polycomb protein SCMH1 0.0055 0.0243 0.0243
Brugia malayi beta-lactamase 0.0079 0.0398 0.0703
Echinococcus granulosus tyrosine protein kinase Src64B 0.0037 0.0128 0.0212
Mycobacterium tuberculosis Probable lipase LipE 0.0079 0.0398 0.0703
Brugia malayi beta-lactamase family protein 0.0079 0.0398 0.0703
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0073 0.013
Onchocerca volvulus 0.0056 0.0247 0.041
Loa Loa (eye worm) SRC-1 0.0037 0.0128 0.0199
Mycobacterium ulcerans acyl-CoA synthetase 0.0098 0.0519 0.0918
Brugia malayi Importin beta-1 subunit 0.0033 0.0103 0.0181
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0237 0.0899
Loa Loa (eye worm) TK protein kinase 0.003 0.0081 0.0115
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0114 0.0626 0.1106
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0073 0.013
Onchocerca volvulus 0.0164 0.0948 0.1652
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0029 0.0073 0.013
Trypanosoma cruzi DNA polymerase kappa, putative 0.006 0.0272 0.0481
Onchocerca volvulus 0.0079 0.0398 0.0678
Toxoplasma gondii aldehyde dehydrogenase 0.0061 0.0281 0.0497
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0016 0.0016
Leishmania major 4-coumarate:coa ligase-like protein 0.0098 0.0519 0.0918
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0118 0.0652 0.0652
Loa Loa (eye worm) hypothetical protein 0.0055 0.0243 0.0403
Echinococcus multilocularis neuropeptide receptor A26 0.0954 0.6047 0.6047
Trichomonas vaginalis antibiotic synthetase, putative 0.0029 0.0073 0.0278
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0077 0.0137
Brugia malayi Doublecortin family protein 0.002 0.0016 0.0027
Echinococcus multilocularis tyrosine protein kinase HCK 0.003 0.0081 0.0081
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0024 0.0046 0.0081
Entamoeba histolytica protein kinase, putative 0.003 0.0081 0.0731
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0029 0.0073 0.013
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0037 0.0128 0.0128
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0037 0.0128 0.0128
Loa Loa (eye worm) glutaminase 2 0.0272 0.1646 0.2889
Schistosoma mansoni rab6-interacting 0.002 0.0016 0.0027
Loa Loa (eye worm) hypothetical protein 0.0036 0.0121 0.0187
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0098 0.0519 0.0918
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative 0.0029 0.0073 0.0578
Mycobacterium ulcerans esterase/lipase LipP 0.0079 0.0398 0.0703
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0894 0.5658 1
Onchocerca volvulus 0.0079 0.0398 0.0678
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0037 0.0127 0.0224
Echinococcus multilocularis RUN 0.002 0.0016 0.0016
Trichomonas vaginalis conserved hypothetical protein 0.0425 0.2633 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0024 0.0046 0.0081
Mycobacterium ulcerans hypothetical protein 0.0079 0.0398 0.0703
Schistosoma mansoni hypothetical protein 0.0056 0.0247 0.0437
Loa Loa (eye worm) hypothetical protein 0.0037 0.0125 0.0194
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0237 0.0899
Loa Loa (eye worm) TK protein kinase 0.0034 0.0105 0.0158
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0153 0.027
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0073 0.013
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0069 0.0334 0.059
Loa Loa (eye worm) glutathione reductase 0.005 0.0211 0.0347
Onchocerca volvulus 0.0029 0.0073 0.0102
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0054 0.0237 0.0418
Echinococcus granulosus tyrosine protein kinase Src42A 0.0033 0.0098 0.0162
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0029 0.0073 0.013
Mycobacterium tuberculosis Hypothetical protein 0.0425 0.2633 0.4653
Toxoplasma gondii Acetyl-coenzyme A synthetase 2, putative 0.0029 0.0073 0.013
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0033 0.0098 0.0098
Trypanosoma brucei DNA polymerase IV, putative 0.006 0.0272 0.0481
Mycobacterium tuberculosis Probable dehydrogenase 0.0114 0.0626 0.1106
Schistosoma mansoni acetyl-CoA synthetase 0.0029 0.0073 0.013
Trichomonas vaginalis importin beta-1, putative 0.0027 0.0062 0.0236
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0054 0.0237 0.0392
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0398 0.0703
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0398 0.0703
Trypanosoma brucei unspecified product 0.0023 0.0035 0.0062
Trypanosoma cruzi DNA polymerase kappa, putative 0.006 0.0272 0.0481
Loa Loa (eye worm) hypothetical protein 0.0073 0.036 0.061
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0127 0.0224
Echinococcus granulosus mitogen activated protein kinase 3 0.0054 0.0237 0.0391
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0029 0.0073 0.0073
Toxoplasma gondii HEAT repeat-containing protein 0.0033 0.0103 0.0181
Brugia malayi Inositol-1 0.0037 0.0127 0.0224
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0016 0.0026
Echinococcus granulosus importin subunit beta 1 0.0033 0.0103 0.017
Loa Loa (eye worm) hypothetical protein 0.0033 0.0101 0.0152
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0054 0.0237 0.0418
Mycobacterium ulcerans beta-lactamase 0.0079 0.0398 0.0703
Schistosoma mansoni inositol monophosphatase 0.0037 0.0127 0.0224
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0033 0.0101 0.0101
Loa Loa (eye worm) hypothetical protein 0.0098 0.0519 0.0893
Loa Loa (eye worm) inositol-1 0.0037 0.0127 0.0198
Entamoeba histolytica acyl-coA synthetase, putative 0.0098 0.0519 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0103 0.0181
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0033 0.0101 0.0167
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0054 0.0237 0.0418
Loa Loa (eye worm) hypothetical protein 0.0273 0.1649 0.2896
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0079 0.0398 0.0703
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.0127 1
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0029 0.0073 0.013
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0034 0.0105 0.0105
Mycobacterium tuberculosis Conserved protein 0.0079 0.0398 0.0703
Plasmodium vivax acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0237 0.0899
Loa Loa (eye worm) hypothetical protein 0.0164 0.0948 0.1652
Leishmania major hypothetical protein, conserved 0.0079 0.0398 0.0703
Brugia malayi hypothetical protein 0.002 0.0016 0.0027
Brugia malayi polk-prov protein 0.0037 0.0125 0.0221
Echinococcus granulosus thioredoxin glutathione reductase 0.005 0.0211 0.035
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0127 0.0482
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0054 0.0237 0.0418
Mycobacterium ulcerans glutaminase 0.0272 0.1646 0.2908
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0281 0.0497
Brugia malayi RNA binding protein 0.0066 0.0313 0.0554
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0292 0.1771 0.313
Echinococcus granulosus dna polymerase kappa 0.006 0.0272 0.045
Schistosoma mansoni terminal deoxycytidyl transferase 0.0033 0.0101 0.0179
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Echinococcus granulosus tar DNA binding protein 0.0066 0.0313 0.0518
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0016 0.0026
Leishmania major trypanothione reductase 0.005 0.0211 0.0374
Brugia malayi Thioredoxin reductase 0.005 0.0211 0.0374
Plasmodium falciparum thioredoxin reductase 0.005 0.0211 0.0374
Schistosoma mansoni DNA polymerase eta 0.0033 0.0101 0.0179
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0029 0.0073 0.013
Leishmania major 4-coumarate:coa ligase-like protein 0.0098 0.0519 0.0918
Loa Loa (eye worm) hypothetical protein 0.0053 0.0229 0.0378
Echinococcus granulosus dna polymerase eta 0.0033 0.0101 0.0167
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0127 0.0708 0.1252
Brugia malayi mbt repeat family protein 0.0055 0.0243 0.043
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0073 0.036 0.0636
Plasmodium falciparum importin beta, putative 0.0033 0.0103 0.0181
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0127 0.0224
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0121 0.0214
Giardia lamblia Kinase, CMGC MAPK 0.0054 0.0237 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0398 0.0703
Echinococcus multilocularis importin subunit beta 1 0.0033 0.0103 0.0103
Mycobacterium ulcerans bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase 0.0029 0.0073 0.013
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0355 0.2181 0.3838
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0054 0.0237 0.0418
Brugia malayi SRC-1 0.0037 0.0128 0.0226
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0069 0.0334 0.059
Mycobacterium ulcerans acyl-CoA synthetase 0.0098 0.0519 0.0918
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0103 0.0181
Loa Loa (eye worm) hypothetical protein 0.0029 0.0073 0.0102
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0127 0.0708 0.1137
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0079 0.0398 0.0703
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.004 0.0144 0.0254
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0144 0.0254
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0313 0.0554
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0894 0.5658 1
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0029 0.0073 0.013
Schistosoma mansoni glutaminase 0.0272 0.1646 0.2908
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0046 0.0081
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0073 0.036 0.0636
Trypanosoma brucei hypothetical protein, conserved 0.0079 0.0398 0.0703
Schistosoma mansoni lipoxygenase 0.0118 0.0652 0.1152
Plasmodium vivax glutathione reductase, putative 0.005 0.0211 0.0374
Brugia malayi ImpB/MucB/SamB family protein 0.0033 0.0101 0.0179
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0037 0.0127 0.1712
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0029 0.0073 0.0102
Brugia malayi mbt repeat family protein 0.0055 0.0243 0.043
Onchocerca volvulus 0.0029 0.0073 0.0102
Loa Loa (eye worm) glutaminase 0.0272 0.1646 0.2889
Loa Loa (eye worm) thymidylate synthase 0.0894 0.5658 1
Trypanosoma brucei DNA polymerase IV, putative 0.006 0.0272 0.0481
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0313 0.0528
Onchocerca volvulus 0.0894 0.5658 1
Mycobacterium ulcerans thymidylate synthase 0.0894 0.5658 1
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.005 0.0211 0.0374
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.0062 0.0236
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.0127 0.021
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Mycobacterium ulcerans hypothetical protein 0.0154 0.088 0.1555
Trichomonas vaginalis inositol monophosphatase, putative 0.0037 0.0127 0.0482
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0016 0.0016
Loa Loa (eye worm) hypothetical protein 0.0033 0.0103 0.0154
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0034 0.0105 0.0173
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0292 0.1771 0.313
Leishmania major acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0079 0.0398 0.0703
Echinococcus granulosus neuropeptide s receptor 0.0954 0.6047 1
Echinococcus multilocularis SAM and MBT domain containing protein 0.0055 0.0243 0.0243
Echinococcus granulosus tyrosine protein kinase Fyn 0.0037 0.0128 0.0212
Plasmodium falciparum acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Mycobacterium ulcerans acyl-CoA synthetase 0.0098 0.0519 0.0918
Echinococcus multilocularis mitogen activated protein kinase 0.0054 0.0237 0.0237
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0029 0.0073 0.013
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Brugia malayi glutathione reductase 0.005 0.0211 0.0374
Plasmodium vivax hypothetical protein, conserved 0.0079 0.0398 0.0703
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0114 0.0626 0.1106
Trichomonas vaginalis glutaminase, putative 0.0272 0.1646 0.625
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0073 0.013
Loa Loa (eye worm) hypothetical protein 0.0098 0.0519 0.0893
Trypanosoma cruzi trypanothione reductase, putative 0.005 0.0211 0.0374
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.0229 0.0405
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Plasmodium falciparum acyl-CoA synthetase 0.0073 0.036 0.0636
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Mycobacterium leprae conserved hypothetical protein 0.0079 0.0398 0.0581
Brugia malayi AMP-binding enzyme family protein 0.0098 0.0519 0.0918
Echinococcus multilocularis tyrosine protein kinase Srms 0.0034 0.0105 0.0105
Echinococcus granulosus beta LACTamase domain containing family member 0.0079 0.0398 0.0658
Schistosoma mansoni tyrosine kinase 0.0037 0.0128 0.0226
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0029 0.0073 0.013
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0055 0.0243 0.0403
Echinococcus multilocularis survival motor neuron protein 1 0.0273 0.1649 0.1649
Brugia malayi glutaminase DH11.1 0.0272 0.1646 0.2908
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0398 0.1512
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.0229 0.0405
Brugia malayi acetyl-Coenzyme A synthetase 2 0.0029 0.0073 0.013
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0114 0.0626 0.1106
Schistosoma mansoni hypothetical protein 0.0036 0.0121 0.0214
Schistosoma mansoni myelin transcription factor 1 myt1 0.0063 0.0292 0.0517
Leishmania major GTP-binding protein, putative 0.0024 0.0046 0.0081
Echinococcus granulosus Polycystic kidney disease protein 0.002 0.0016 0.0026
Echinococcus granulosus tyrosine protein kinase Lyn 0.0038 0.0131 0.0217
Onchocerca volvulus 0.0029 0.0073 0.0102
Schistosoma mansoni loxhd1 0.002 0.0016 0.0027
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0313 0.0554
Plasmodium falciparum glutathione reductase 0.005 0.0211 0.0374
Loa Loa (eye worm) hypothetical protein 0.0073 0.036 0.061
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0029 0.0073 0.013
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0098 0.0519 0.0918
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0063 0.0292 0.0517
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.0062 0.0236
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0041 0.0153 0.027
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0098 0.0519 0.0799
Mycobacterium ulcerans O-succinylbenzoic acid--CoA ligase 0.0029 0.0073 0.013
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0056 0.0247 0.0437
Brugia malayi TAR-binding protein 0.0066 0.0313 0.0554
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0029 0.0073 0.013
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0281 0.0497
Echinococcus granulosus thymidylate synthase 0.0894 0.5658 0.9357
Trypanosoma brucei unspecified product 0.0023 0.0035 0.0062
Mycobacterium leprae Probable lipase LipE 0.0079 0.0398 0.0581
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0398 0.1512
Onchocerca volvulus 0.0029 0.0073 0.0102
Loa Loa (eye worm) hypothetical protein 0.0073 0.036 0.061
Schistosoma mansoni serine/threonine protein kinase 0.0054 0.0237 0.0418
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0073 0.013
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0073 0.036 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0154 0.088 0.1555
Echinococcus granulosus tyrosine protein kinase Fyn 0.0037 0.0128 0.0212
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0313 0.0313
Brugia malayi protein-tyrosine kinase 0.0034 0.0105 0.0185
Trypanosoma cruzi DNA polymerase kappa, putative 0.006 0.0272 0.0481
Treponema pallidum NADH oxidase 0.0017 0 0.5
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Brugia malayi hypothetical protein 0.0425 0.2633 0.4653
Trypanosoma brucei long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0073 0.013
Echinococcus multilocularis thioredoxin glutathione reductase 0.005 0.0211 0.0211
Brugia malayi hypothetical protein 0.002 0.0016 0.0027
Mycobacterium tuberculosis Probable oxidoreductase 0.0127 0.0708 0.1252
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0061 0.0281 0.0497
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0894 0.5658 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0098 0.0519 0.0918
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0073 0.013
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0118 0.0652 0.1077
Mycobacterium ulcerans acetyl-CoA synthetase 0.0029 0.0073 0.013
Schistosoma mansoni survival motor neuron protein 0.0056 0.0247 0.0437
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0073 0.013
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0069 0.0334 0.059
Mycobacterium ulcerans hypothetical protein 0.0098 0.0519 0.0918
Echinococcus multilocularis mitogen activated protein kinase 3 0.0054 0.0237 0.0237
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0102 0.0051
Trichomonas vaginalis esterase, putative 0.0079 0.0398 0.1512
Brugia malayi hypothetical protein 0.0164 0.0948 0.1675
Leishmania major DNA polymerase eta, putative 0.0033 0.0101 0.0179
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.005 0.0211 0.0372
Plasmodium falciparum LCCL domain-containing protein 0.002 0.0016 0.0027
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0138 0.0779 0.1377
Loa Loa (eye worm) mbt repeat family protein 0.0055 0.0243 0.0403
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0033 0.0101 0.0179
Brugia malayi ImpB/MucB/SamB family protein 0.0033 0.0101 0.0179
Echinococcus granulosus snurportin 1 0.0355 0.2181 0.3607
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0041 0.0153 0.027
Mycobacterium tuberculosis Conserved hypothetical protein 0.0033 0.0101 0.0179
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0313 0.0528
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0029 0.0073 0.013
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0114 0.0626 0.1106
Trypanosoma brucei DNA polymerase kappa, putative 0.0037 0.0125 0.0221
Entamoeba histolytica acyl-CoA synthetase, putative 0.0098 0.0519 1
Leishmania major long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0073 0.013
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0079 0.0398 0.0678
Mycobacterium tuberculosis PROBABLE FATTY-ACID-CoA LIGASE FADD18 (FRAGMENT) (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.0048 0.0084
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0024 0.0046 0.0054
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0037 0.0128 0.0128
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0063 0.0292 0.0484
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Trypanosoma brucei DNA polymerase IV, putative 0.0053 0.023 0.0406
Schistosoma mansoni ran 0.0024 0.0046 0.0081
Echinococcus granulosus histone acetyltransferase MYST2 0.0063 0.0292 0.0484
Schistosoma mansoni polycystin 1-related 0.002 0.0016 0.0027
Echinococcus granulosus survival motor neuron protein 1 0.0273 0.1649 0.2728
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0061 0.0281 0.0465
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0024 0.0046 0.0046
Trypanosoma brucei trypanothione reductase 0.005 0.0211 0.0374
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0281 0.0497
Echinococcus multilocularis snurportin 1 0.0355 0.2181 0.2181
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0073 0.013
Echinococcus granulosus RUN 0.002 0.0016 0.0026
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.0127 0.0127
Plasmodium vivax thioredoxin reductase, putative 0.005 0.0211 0.0374
Onchocerca volvulus 0.0055 0.0243 0.0403
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0037 0.0128 0.0128
Echinococcus granulosus mitogen activated protein kinase 0.0054 0.0237 0.0391
Onchocerca volvulus 0.0079 0.0398 0.0678
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.0229 0.0378
Echinococcus granulosus neuropeptide receptor A26 0.0954 0.6047 1
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.0272 0.0481
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0237 0.0899
Echinococcus granulosus tyrosine kinase 0.0034 0.0105 0.0173
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0029 0.0073 0.013
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0073 0.013
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0398 0.1512
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0024 0.0046 0.0081
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0054 0.0237 0.0418
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0037 0.0127 0.0224
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0061 0.0281 0.0281
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0079 0.0398 0.0703
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0127 0.0482
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0398 0.1512
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0037 0.0128 0.0128
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0024 0.0046 0.0081
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0102 0.018
Schistosoma mansoni tyrosine kinase 0.0037 0.0128 0.0226
Echinococcus granulosus SAM and MBT domain containing protein 0.0055 0.0243 0.0402
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0054 0.0237 0.0418
Trypanosoma brucei DNA polymerase kappa, putative 0.0037 0.0125 0.0221
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0024 0.0046 0.1942
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Schistosoma mansoni hypothetical protein 0.002 0.0016 0.0027
Leishmania major acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Mycobacterium ulcerans DNA polymerase IV 0.006 0.0272 0.0481
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0505 0.3147 0.5562
Brugia malayi beta-lactamase family protein 0.0079 0.0398 0.0703
Loa Loa (eye worm) beta-lactamase 0.0079 0.0398 0.0678
Schistosoma mansoni rab6-interacting 0.002 0.0016 0.0027
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0029 0.0073 0.013
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0292 0.1771 0.313
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0398 0.1512
Loa Loa (eye worm) thioredoxin reductase 0.005 0.0211 0.0347
Loa Loa (eye worm) hypothetical protein 0.0073 0.036 0.061
Schistosoma mansoni ran 0.0024 0.0046 0.0081
Loa Loa (eye worm) RNA binding protein 0.0066 0.0313 0.0528
Echinococcus granulosus GTP binding nuclear protein Ran 0.0024 0.0046 0.0076
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0037 0.0128 0.0128
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0029 0.0073 0.0121
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Brugia malayi AMP-binding enzyme family protein 0.0098 0.0519 0.0918
Mycobacterium ulcerans lipase LipD 0.0079 0.0398 0.0703
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0037 0.0128 0.0212
Mycobacterium ulcerans DNA polymerase IV 0.006 0.0272 0.0481
Mycobacterium tuberculosis Probable lipase LipD 0.0079 0.0398 0.0703
Loa Loa (eye worm) hypothetical protein 0.0098 0.0519 0.0893
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0055 0.0243 0.043
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0894 0.5658 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.006 0.0272 0.0481
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0138 0.0779 0.1377
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0037 0.0128 0.0128
Brugia malayi thymidylate synthase 0.0894 0.5658 1
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0127 0.0224
Trypanosoma brucei acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.006 0.0272 0.1034
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0098 0.0519 0.0918
Echinococcus multilocularis dna polymerase kappa 0.006 0.0272 0.0272
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0313 0.0554
Echinococcus multilocularis thymidylate synthase 0.0894 0.5658 0.5658
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0024 0.0046 0.0081
Schistosoma mansoni hypothetical protein 0.0355 0.2181 0.3854
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0077 0.0137
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0313 0.0554
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0425 0.2633 0.4653
Schistosoma mansoni sex comb on midleg homolog 0.0055 0.0243 0.043
Schistosoma mansoni hypothetical protein 0.0019 0.001 0.0017
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0029 0.0073 0.013
Echinococcus granulosus tyrosine protein kinase HCK 0.003 0.0081 0.0133
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0313 0.0554
Loa Loa (eye worm) hypothetical protein 0.0063 0.0292 0.0491
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0098 0.0519 0.0918
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0063 0.0292 0.0292
Echinococcus multilocularis neuropeptide s receptor 0.0954 0.6047 0.6047
Mycobacterium tuberculosis Probable hydrolase 0.0079 0.0398 0.0703
Echinococcus multilocularis tyrosine protein kinase Blk 0.0034 0.0105 0.0105
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0073 0.013
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0046 0.0081
Schistosoma mansoni lipoxygenase 0.0083 0.0422 0.0745
Trypanosoma cruzi importin beta-1 subunit, putative 0.0027 0.0062 0.011
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0037 0.0128 0.0128
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0281 0.0497
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0313 0.0554
Loa Loa (eye worm) MBCTL1 0.0063 0.0292 0.0491
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0029 0.0073 0.013
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0281 0.0497
Schistosoma mansoni hypothetical protein 0.0335 0.2048 0.3619
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0037 0.0128 0.0212
Trypanosoma brucei DNA polymerase eta, putative 0.0033 0.0101 0.0179
Mycobacterium tuberculosis Probable esterase LipL 0.0079 0.0398 0.0703
Loa Loa (eye worm) hypothetical protein 0.0079 0.0398 0.0678
Mycobacterium tuberculosis Conserved protein 0.0079 0.0398 0.0703
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.004 0.0144 0.0254
Brugia malayi AMP-binding enzyme family protein 0.0098 0.0519 0.0918
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0114 0.0626 0.099
Toxoplasma gondii hypothetical protein 0.0047 0.0192 0.0339
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0098 0.0519 0.0799
Echinococcus multilocularis dna polymerase eta 0.0033 0.0101 0.0101
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0098 0.0519 0.0918
Entamoeba histolytica deoxycytidyl transferase, putative 0.0033 0.0101 0.1168
Leishmania major DNA polymerase kappa, putative 0.004 0.0144 0.0254
Mycobacterium tuberculosis Conserved protein 0.0079 0.0398 0.0703
Leishmania major mitochondrial DNA polymerase beta 0.0292 0.1771 0.313
Brugia malayi hypothetical protein 0.0273 0.1649 0.2915
Brugia malayi MAP kinase sur-1 0.0054 0.0237 0.0418
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0073 0.013
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0398 0.0703
Echinococcus granulosus polycomb protein SCMH1 0.0055 0.0243 0.0402

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 0.0001 M Inhibition of putrescine binding to Diamine oxidase of porcine kidney ChEMBL. 15689151
IC50 (binding) > 0.0001 M Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum ChEMBL. 15689151
IC50 (binding) > 0.0001 M Inhibitory concentration for rat liver Monoamine oxidase B using beta-phenylethylamine ChEMBL. 15689151
IC50 (binding) > 0.0001 M Inhibition of putrescine binding to Pea seedling amine oxidase ChEMBL. 15689151
IC50 (binding) = 0.0015 M Inhibition of beta-phenylethylamine binding to Hansenula polymorpha amine oxidase ChEMBL. 15689151

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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