Detailed information for compound 1355365

Basic information

Technical information
  • TDR Targets ID: 1355365
  • Name: N-[(2S)-4-methyl-1-oxo-1-(pyridin-3-ylmethyla mino)pentan-2-yl]-1-phenylsulfonylpiperidine- 4-carboxamide
  • MW: 472.6 | Formula: C24H32N4O4S
  • H donors: 2 H acceptors: 5 LogP: 2.33 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(C[C@@H](C(=O)NCc1cccnc1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1)C
  • InChi: 1S/C24H32N4O4S/c1-18(2)15-22(24(30)26-17-19-7-6-12-25-16-19)27-23(29)20-10-13-28(14-11-20)33(31,32)21-8-4-3-5-9-21/h3-9,12,16,18,20,22H,10-11,13-15,17H2,1-2H3,(H,26,30)(H,27,29)/t22-/m0/s1
  • InChiKey: XOHAZRFWBDLLLN-QFIPXVFZSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[(1S)-3-methyl-1-(3-pyridylmethylcarbamoyl)butyl]-1-phenylsulfonyl-piperidine-4-carboxamide
  • N-[(1S)-3-methyl-1-[oxo-(3-pyridylmethylamino)methyl]butyl]-1-phenylsulfonyl-4-piperidinecarboxamide
  • N-[(1S)-3-methyl-1-(3-pyridylmethylcarbamoyl)butyl]-1-phenylsulfonyl-isonipecotamide
  • N-[(2S)-4-methyl-1-oxo-1-(pyridin-3-ylmethylamino)pentan-2-yl]-1-phenylsulfonyl-piperidine-4-carboxamide

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 granulosus solute carrier family 22 0.0015 0.0084 0.0354
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0283 0.1278
Giardia lamblia Prolyl-tRNA synthetase 0.0032 0.0469 1
Brugia malayi Cam kinase protein 1 0.0033 0.0484 0.221
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0589 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0074 0.1415 0.6537
Echinococcus multilocularis multidrug resistance protein 1 0.0074 0.1415 0.6537
Trichomonas vaginalis abcb9, putative 0.0074 0.1415 0.641
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0354
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0023 0.0267 0.0185
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0012 0.0008 0.0004
Brugia malayi hypothetical protein 0.0015 0.0084 0.035
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0033 0.0484 0.2212
Giardia lamblia Multidrug resistance-associated protein Mrp2 0.0022 0.0249 0.4279
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0019 0.018 0.0796
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0023 0.0267 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0069 0.1288 0.5797
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0469 0.214
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0283 1
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0022 0.0249 0.1116
Echinococcus granulosus hyperpolarization activated cyclic 0.0019 0.018 0.0799
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0074 0.1415 0.6537
Entamoeba histolytica protein kinase, putative 0.0033 0.0484 0.2018
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0033 0.0484 0.0404
Loa Loa (eye worm) hypothetical protein 0.0023 0.0267 0.0734
Loa Loa (eye worm) hypothetical protein 0.0032 0.0469 0.1308
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0074 0.1415 0.6537
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0023 0.0267 0.0185
Entamoeba histolytica P-glycoprotein-2, putative 0.0074 0.1415 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Loa Loa (eye worm) sugar transporter 0.0108 0.216 0.6113
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0493 0.8107
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0084 0.0214
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.035
Brugia malayi Sugar transporter family protein 0.0108 0.216 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0283 0.0781
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0019 0.018 0.0796
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0074 0.1415 0.641
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0032 0.0469 0.214
Plasmodium falciparum calcium-dependent protein kinase 5 0.0033 0.0484 0.0476
Echinococcus granulosus cGMP dependent protein kinase 0.0012 0.0008 0.0004
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Plasmodium falciparum ABC transporter B family member 3, putative 0.0023 0.0267 0.0259
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0023 0.0267 0.1695
Leishmania major glucose transporter/membrane transporter D2, putative 0.0033 0.0493 0.3181
Schistosoma mansoni multidrug resistance protein 0.0023 0.0267 0.1201
Toxoplasma gondii sugar transporter ST3 0.0015 0.0084 0.0115
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0074 0.1415 1
Leishmania major lysyl-tRNA synthetase, putative 0.0024 0.0283 0.1803
Plasmodium falciparum ABC transporter B family member 6, putative 0.0023 0.0267 0.0259
Plasmodium vivax calcium-dependent protein kinase, putative 0.0033 0.0484 0.0404
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0023 0.0267 1
Toxoplasma gondii facilitative glucose transporter GT1 0.0108 0.216 0.3279
Entamoeba histolytica multidrug resistance protein, putative 0.0023 0.0267 0.0156
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0267 0.9415
Echinococcus granulosus ATP binding cassette sub family B 0.0022 0.0249 0.1119
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0019 0.018 0.0796
Giardia lamblia Multidrug resistance-associated protein 1 0.0023 0.0267 0.4752
Plasmodium vivax multidrug resistance protein 1, putative 0.0074 0.1415 0.1342
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0354
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0033 0.0484 0.0725
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0023 0.0267 0.0734
Schistosoma mansoni multidrug resistance protein 0.0023 0.0267 0.1201
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0012 0.0008 0.0004
Entamoeba histolytica protein kinase, putative 0.0033 0.0484 0.2018
Echinococcus granulosus hyperpolarization activated cyclic 0.0019 0.018 0.0799
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0174 0.3649 0.3595
Toxoplasma gondii lysine-tRNA ligase 0.0024 0.0283 0.0419
Brugia malayi ABC transporter transmembrane region family protein 0.0023 0.0267 0.1201
Plasmodium falciparum calcium-dependent protein kinase 2 0.0033 0.0484 0.0476
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0493 0.1973
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0032 0.0469 1
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0015 0.0084 0.0354
Echinococcus multilocularis lysyl tRNA synthetase 0.0024 0.0283 0.1281
Brugia malayi hypothetical protein 0.0015 0.0084 0.035
Brugia malayi lysyl-tRNA synthetase 0.0024 0.0283 0.1278
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0019 0.018 0.0799
Brugia malayi ABC transporter transmembrane region family protein 0.0023 0.0267 0.1201
Loa Loa (eye worm) hypothetical protein 0.0019 0.018 0.0486
Entamoeba histolytica P-glycoprotein-1 0.0074 0.1415 1
Plasmodium falciparum proline--tRNA ligase 0.0038 0.0589 0.0581
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0354
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0021 0.0217 0.0641
Trypanosoma cruzi multidrug resistance protein E, putative 0.0023 0.0267 0.3622
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0023 0.0267 0.3622
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0026 0.0331 0.1501
Plasmodium falciparum multidrug resistance-associated protein 2 0.0023 0.0267 0.0259
Giardia lamblia Multidrug resistance-associated protein 1 0.0023 0.0267 0.4752
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0019 0.018 0.0799
Brugia malayi ABC transporter 0.0022 0.0249 0.1116
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0168 0.3529 1
Echinococcus granulosus calcium dependent protein kinase 0.0031 0.0438 0.2
Brugia malayi major facilitator superfamily protein 0.0015 0.0084 0.035
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0074 0.1415 0.2143
Plasmodium falciparum hexose transporter 0.0108 0.216 0.2154
Schistosoma mansoni glucose transport protein 0.0108 0.216 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0026 0.0331 0.1504
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.035
Giardia lamblia Lysyl-tRNA synthetase 0.0024 0.0283 0.5182
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0033 0.0484 0.7919
Plasmodium vivax CDK-related protein kinase 6, putative 0.0456 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0023 0.0267 0.1204
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.0023 0.0267 0.3622
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Giardia lamblia MRP-like ABC transporter 0.0023 0.0267 0.4752
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0108 0.216 1
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.002 0.0202 0.0889
Trichomonas vaginalis ABC transporter, putative 0.0074 0.1415 0.641
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.035
Plasmodium falciparum ABC transporter B family member 7, putative 0.0023 0.0267 0.0259
Schistosoma mansoni voltage-gated potassium channel 0.0085 0.1657 0.766
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0023 0.0267 0.0394
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0019 0.018 0.0462
Echinococcus multilocularis voltage gated potassium channel 0.0026 0.0331 0.1504
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0493 0.8107
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0015 0.0084 0.2954
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0493 0.8107
Echinococcus granulosus sodium channel protein 0.008 0.1533 0.7086
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0074 0.1415 0.6537
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0023 0.0267 0.1201
Schistosoma mansoni protein kinase 0.0033 0.0484 0.221
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0078 0.1505 0.6955
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0019 0.018 0.0799
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Plasmodium vivax proline--tRNA ligase, putative 0.0038 0.0589 0.051
Echinococcus granulosus multidrug resistance protein 1 0.0052 0.091 0.4194
Loa Loa (eye worm) ABC transporter 0.0023 0.0267 0.0734
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0354
Toxoplasma gondii ABC transporter family protein 0.0023 0.0267 0.0394
Brugia malayi ABC transporter family protein 0.0023 0.0267 0.1201
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.0283 0.0961
Trichomonas vaginalis ABC transporter, putative 0.0074 0.1415 0.641
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394
Brugia malayi Cyclic-nucleotide gated cation channel 0.0019 0.018 0.0796
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.216 1
Giardia lamblia Multidrug resistance-associated protein 1 0.0022 0.0249 0.4279
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Loa Loa (eye worm) ABC transporter 0.0023 0.0267 0.0734
Plasmodium falciparum mitogen-activated protein kinase 2 0.0174 0.3649 0.3643
Brugia malayi ABC transporter family protein 0.0074 0.1415 0.6536
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0078 0.1505 0.6954
Schistosoma mansoni voltage-gated potassium channel 0.0026 0.0331 0.1501
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0493 0.1973
Leishmania major ABC-thiol transporter 0.0023 0.0267 0.1695
Trichomonas vaginalis ABC transporter, putative 0.0074 0.1415 0.641
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0019 0.018 0.0799
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Toxoplasma gondii sugar transporter ST1 0.0015 0.0084 0.0115
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0033 0.0484 0.221
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0023 0.0267 0.1695
Leishmania major p-glycoprotein 0.0074 0.1415 0.9225
Brugia malayi ABC transporter family protein 0.0023 0.0267 0.1201
Echinococcus multilocularis multidrug resistance associated protein 1 0.0023 0.0267 0.1204
Giardia lamblia Hypothetical protein 0.0022 0.0249 0.4279
Toxoplasma gondii protein kinase, putative 0.0304 0.6571 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0022 0.0249 0.0794
Trichomonas vaginalis ABC transporter, putative 0.0074 0.1415 0.641
Brugia malayi ABC transporter 0.0023 0.0267 0.1201
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0013 0.0042 0.0094
Echinococcus granulosus cGMP dependent protein kinase 1 0.0012 0.0008 0.0004
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0078 0.1505 0.4251
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.035
Trichomonas vaginalis CAMK family protein kinase 0.0033 0.0484 0.1927
Plasmodium vivax ABC transporter B family member 7, putative 0.0023 0.0267 0.0185
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0033 0.0484 0.0404
Entamoeba histolytica ABC transporter, putative 0.0023 0.0267 0.0156
Leishmania major glucose transporter, lmgt1 0.0033 0.0493 0.3181
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.216 1
Leishmania major protein kinase, putative 0.0033 0.0484 0.3119
Loa Loa (eye worm) hypothetical protein 0.0168 0.3529 1
Plasmodium vivax ABC transporter B family member 3, putative 0.0023 0.0267 0.0185
Echinococcus multilocularis General substrate transporter 0.0092 0.1821 0.8422
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0174 0.3649 0.5547
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0074 0.1415 0.2143
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0074 0.1415 0.641
Trypanosoma cruzi hexose transporter 0.0033 0.0493 0.8107
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0023 0.0267 0.1375
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0019 0.018 0.0799
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0019 0.018 0.0799
Schistosoma mansoni glucose transport protein 0.0108 0.216 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0331 0.0918
Schistosoma mansoni voltage-gated potassium channel 0.0019 0.018 0.0796
Schistosoma mansoni smdr1 0.0023 0.0267 0.1201
Echinococcus multilocularis hyperpolarization activated cyclic 0.0019 0.018 0.0799
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0024 0.0283 0.395
Brugia malayi Sugar transporter family protein 0.0015 0.0084 0.035
Schistosoma mansoni protein kinase 0.0033 0.0484 0.221
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0267 0.9415
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0589 0.3808
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0026 0.0331 0.1504
Toxoplasma gondii sugar transporter ST2 0.0015 0.0084 0.0115
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Plasmodium vivax ABC transporter B family member 5, putative 0.0023 0.0267 0.0185
Loa Loa (eye worm) hypothetical protein 0.0074 0.1415 0.3995
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0493 0.8107
Plasmodium vivax lysine--tRNA ligase, putative 0.0024 0.0283 0.0201
Trypanosoma brucei glucose transporter 1E 0.0033 0.0493 0.8107
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0493 0.1973
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0032 0.0469 0.2143
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0023 0.0267 0.3622
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0493 0.8107
Plasmodium falciparum multidrug resistance protein 1 0.0074 0.1415 0.1408
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.216 1
Schistosoma mansoni multidrug resistance protein 0.0023 0.0267 0.1201
Echinococcus multilocularis synaptic vesicle 2 protein 0.0015 0.0084 0.0354
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0023 0.0267 0.1695
Echinococcus granulosus multidrug resistance protein 1 0.0074 0.1415 0.6537
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0354
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0267 0.0156
Echinococcus granulosus multidrug resistance associated protein 1 0.0023 0.0267 0.1204
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0493 0.1973
Trypanosoma brucei multidrug resistance protein E 0.0023 0.0267 0.3622
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0074 0.1415 0.641
Chlamydia trachomatis lysine--tRNA ligase 0.0024 0.0283 0.2002
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0469 0.214
Brugia malayi hypothetical protein 0.0015 0.0084 0.035
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0074 0.1415 1
Schistosoma mansoni glucose transporter 0.0015 0.0084 0.035
Mycobacterium ulcerans sugar transporter 0.0015 0.0084 0.2954
Leishmania major p-glycoprotein e 0.0023 0.0267 0.1695
Brugia malayi major facilitator superfamily protein 0.0015 0.0084 0.035
Mycobacterium ulcerans integral membrane transport protein 0.0015 0.0084 0.2954
Brugia malayi P-glycoprotein-like protein 0.0023 0.0267 0.1201
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0019 0.018 0.0796
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0493 0.1973
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0038 0.0589 0.0885
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0493 0.1973
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0267 0.0156
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Plasmodium vivax ABC transporter B family member 4, putative 0.0023 0.0267 0.0185
Plasmodium falciparum multidrug resistance-associated protein 1 0.0023 0.0267 0.0259
Entamoeba histolytica P-glyco protein 6, putative 0.0074 0.1415 1
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0024 0.0283 0.395
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0493 0.1973
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0015 0.0084 0.0075
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0084 0.0214
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0023 0.0267 0.9415
Entamoeba histolytica P-glycoprotein-2 0.0074 0.1415 1
Echinococcus granulosus cGMP dependent protein kinase 1 0.0012 0.0008 0.0004
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.035
Loa Loa (eye worm) hypothetical protein 0.0026 0.0333 0.0922
Plasmodium falciparum calcium-dependent protein kinase 1 0.0033 0.0484 0.0476
Plasmodium falciparum calcium-dependent protein kinase 3 0.0033 0.0484 0.0476
Brugia malayi multidrug resistance related protein 1 0.0023 0.0267 0.1201
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0023 0.0267 0.1695
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0033 0.0484 0.1351
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0283 0.1278
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Entamoeba histolytica P-glycoprotein-2 0.0074 0.1415 1
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0019 0.018 0.0486
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.216 1
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0033 0.0484 0.0404
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0074 0.1415 0.3995
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0267 0.9415
Echinococcus granulosus multidrug resistance protein 1 0.0074 0.1415 0.6537
Leishmania major glucose transporter, lmgt3 0.0033 0.0493 0.3181
Treponema pallidum prolyl-tRNA synthetase 0.0011 0 0.5
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.0023 0.0267 0.3622
Schistosoma mansoni multidrug resistance protein 0.0074 0.1415 0.6536
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0015 0.0084 0.035
Toxoplasma gondii ABC transporter, putative 0.0023 0.0267 0.0394
Schistosoma mansoni voltage-gated potassium channel 0.0026 0.0331 0.1501
Plasmodium vivax multidrug resistance protein 2, putative 0.0023 0.0267 0.0185
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0023 0.0267 0.2425
Leishmania major pentamidine resistance protein 1 0.0023 0.0267 0.1695
Plasmodium falciparum calcium-dependent protein kinase 4 0.0033 0.0484 0.0476
Schistosoma mansoni multidrug resistance protein 0.0023 0.0267 0.1201
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0033 0.0484 0.0725
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.0023 0.0267 0.3622
Echinococcus granulosus multidrug resistance protein 1 0.0074 0.1415 0.6537
Trypanosoma brucei p-glycoprotein 0.0023 0.0267 0.3622
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0019 0.018 0.0462
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0023 0.0267 0.1201
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0589 0.3808
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0023 0.0267 0.1695
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0589 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0023 0.0267 0.1204
Echinococcus granulosus multidrug resistance associated protein 7 0.0023 0.0267 0.1204
Plasmodium falciparum ABC transporter B family member 4, putative 0.0023 0.0267 0.0259
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.008 0.1533 0.7086
Plasmodium falciparum lysine--tRNA ligase 0.0024 0.0283 0.0275
Echinococcus multilocularis ATP binding cassette sub family B 0.0023 0.0267 0.1204
Plasmodium falciparum ABC transporter B family member 5, putative 0.0023 0.0267 0.0259
Brugia malayi multidrug resistance protein 3 0.0074 0.1415 0.6536
Echinococcus multilocularis multidrug resistance protein 1 0.0052 0.091 0.4194
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0493 0.8107
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0032 0.0469 0.214
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0023 0.0267 0.3622
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394
Loa Loa (eye worm) sugar transporter 0.0015 0.0084 0.0214
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.035
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0069 0.1288 0.5797
Schistosoma mansoni smdr2 0.0074 0.1415 0.6536
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0032 0.0469 0.2143
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0074 0.1415 0.6537
Loa Loa (eye worm) hypothetical protein 0.0023 0.0267 0.0734
Echinococcus granulosus voltage gated potassium channel 0.0026 0.0331 0.1504
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0022 0.0249 0.0794
Schistosoma mansoni voltage-gated potassium channel 0.0085 0.1657 0.766
Echinococcus granulosus synaptic vesicle 2 protein 0.0015 0.0084 0.0354
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.002 0.0202 0.0889
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0033 0.0484 0.1351
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0023 0.0267 0.0881
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0033 0.0484 0.0725
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0074 0.1397 0.6453
Plasmodium vivax ABC transporter B family member 6, putative 0.0023 0.0267 0.0185
Echinococcus multilocularis hyperpolarization activated cyclic 0.0019 0.018 0.0799
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.216 1
Leishmania major hypothetical protein, conserved 0.0015 0.0084 0.0494
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0074 0.1415 0.641
Schistosoma mansoni 60S ribosomal protein L21 0.0016 0.0113 0.0487
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0074 0.1415 0.641
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0354
Loa Loa (eye worm) hypothetical protein 0.0022 0.0249 0.0682
Trichomonas vaginalis abcb9, putative 0.0074 0.1415 0.641
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0074 0.1415 0.641
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0019 0.018 0.0486
Trichomonas vaginalis taga, putative 0.0074 0.1415 0.641
Loa Loa (eye worm) hypothetical protein 0.0069 0.1287 0.3631
Onchocerca volvulus 0.0074 0.1415 1
Trichomonas vaginalis abcb9, putative 0.0074 0.1415 0.641
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0074 0.1415 0.6537
Echinococcus granulosus General substrate transporter 0.0092 0.1821 0.8422
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Echinococcus multilocularis ATP binding cassette sub family B 0.0023 0.0267 0.1204
Echinococcus granulosus Sugar transporter ERD6 protein 0.0015 0.0084 0.0354
Leishmania major glucose transporter, lmgt2 0.0033 0.0493 0.3181
Echinococcus multilocularis 0.0023 0.0267 0.1204
Echinococcus granulosus ATP binding cassette sub family B 0.0023 0.0267 0.1204
Loa Loa (eye worm) hypothetical protein 0.0168 0.3529 1
Entamoeba histolytica P-glycoprotein-5 0.0074 0.1415 1
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0249 0.0794
Loa Loa (eye worm) multidrug resistance protein 3 0.0074 0.1415 0.3995
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0022 0.0249 0.0794
Loa Loa (eye worm) ABC transporter 0.0023 0.0267 0.0734
Entamoeba histolytica P-glycoprotein 6, putative 0.0023 0.0267 0.0156
Plasmodium vivax hexose transporter 0.0108 0.216 0.2094
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0267 0.0156
Schistosoma mansoni multidrug resistance protein 0.0023 0.0267 0.1201
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394
Schistosoma mansoni glucose transport protein 0.0108 0.216 1
Entamoeba histolytica P-glycoprotein 6, putative 0.0023 0.0267 0.0156
Loa Loa (eye worm) hypothetical protein 0.0074 0.1397 0.3944
Trypanosoma brucei glucose transporter 2A 0.0033 0.0493 0.8107
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0052 0.091 0.3981
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0074 0.1415 0.641
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0589 1
Schistosoma mansoni voltage-gated potassium channel 0.0016 0.0113 0.0487
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0023 0.0267 0.1375
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0019 0.018 0.0796
Brugia malayi ABC transporter family protein 0.0023 0.0267 0.1201
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0267 0.0156
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.216 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0484 0.2212
Leishmania major myo-inositol/proton symporter (MIT) 0.0015 0.0084 0.0494
Schistosoma mansoni protein kinase 0.0033 0.0484 0.221
Loa Loa (eye worm) hypothetical protein 0.0032 0.0469 0.1308
Echinococcus multilocularis ATP binding cassette sub family B 0.0074 0.1397 0.6453
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0024 0.0283 0.3046
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0074 0.1415 0.6537
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0154 0.1383
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0074 0.1415 0.9225
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0015 0.0084 0.2954
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0023 0.0267 0.1695
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0354
Brugia malayi Sugar transporter family protein 0.0015 0.0084 0.035
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0074 0.1415 0.6537
Schistosoma mansoni multidrug resistance protein 0.0074 0.1415 0.6536
Schistosoma mansoni hypothetical protein 0.0108 0.216 1
Echinococcus multilocularis expressed conserved protein 0.0012 0.0008 0.0004
Echinococcus granulosus ATP binding cassette sub family B 0.0023 0.0267 0.1204
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0074 0.1415 0.641
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0023 0.0267 0.9415
Entamoeba histolytica hypothetical protein 0.0024 0.0283 0.0298
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Toxoplasma gondii transporter, major facilitator family protein 0.0015 0.0084 0.0115
Trypanosoma brucei glucose transporter, putative 0.0033 0.0493 0.8107
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0283 1
Plasmodium falciparum multidrug resistance protein 2 0.0023 0.0267 0.0259
Echinococcus granulosus multidrug resistance protein 1 0.0052 0.091 0.4194
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0023 0.0267 0.1695
Loa Loa (eye worm) hypothetical protein 0.0022 0.0249 0.0682
Schistosoma mansoni multidrug resistance protein 0.0022 0.0249 0.1116
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0023 0.0267 0.2425
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0078 0.1505 0.6955
Loa Loa (eye worm) hypothetical protein 0.0074 0.1415 0.3995
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.216 1
Toxoplasma gondii hypothetical protein 0.0168 0.3529 0.5364
Entamoeba histolytica hypothetical protein 0.0023 0.0267 0.0156
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0032 0.0469 0.1855
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.0023 0.0267 0.3622
Leishmania major calcium channel protein, putative,ion transporter, putative 0.008 0.1533 1
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0032 0.0469 0.1889
Echinococcus multilocularis multidrug resistance associated protein 7 0.0023 0.0267 0.1204
Echinococcus multilocularis calcium dependent protein kinase 0.0031 0.0438 0.2
Plasmodium falciparum protein kinase 7 0.0304 0.6571 0.6568
Loa Loa (eye worm) hypothetical protein 0.0168 0.3529 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0074 0.1415 0.6537
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Schistosoma mansoni multidrug resistance protein 0.0074 0.1415 0.6536
Entamoeba histolytica P-glycoprotein 5, putative 0.0074 0.1415 1
Brugia malayi hypothetical protein 0.0023 0.0267 0.1201
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.035
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0023 0.0267 0.3622
Echinococcus multilocularis multidrug resistance protein 1 0.0074 0.1415 0.6537
Brugia malayi ABC transporter transmembrane region family protein 0.0022 0.0249 0.1116
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0074 0.1415 0.641
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.216 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0267 0.0734
Giardia lamblia ABC transporter, putative 0.0023 0.0267 0.4752
Schistosoma mansoni serine/threonine protein kinase 0.0033 0.0484 0.221
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0214
Loa Loa (eye worm) hypothetical protein 0.0033 0.0484 0.1351
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0019 0.018 0.0799
Echinococcus multilocularis sodium channel protein 0.008 0.1533 0.7086
Echinococcus granulosus lysyl tRNA synthetase 0.0024 0.0283 0.1281
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0267 0.0394

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

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

No literature references available for this target.

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