Detailed information for compound 29525

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 330.87 | Formula: C17H29ClNO3-
  • H donors: 1 H acceptors: 1 LogP: 4.65 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCOc1cc(CN(C)C)cc(c1O)OCCCC.[Cl-]
  • InChi: 1S/C17H29NO3.ClH/c1-5-7-9-20-15-11-14(13-18(3)4)12-16(17(15)19)21-10-8-6-2;/h11-12,19H,5-10,13H2,1-4H3;1H/p-1
  • InChiKey: CUDFMGZPWOQTNF-UHFFFAOYSA-M  


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 granulosus Jumonji AT rich interactive domain 1B 0.0039 0.0004 0.0036
Leishmania major trypanothione reductase 0.0145 0.0114 0.0299
Loa Loa (eye worm) MBCTL1 0.0054 0.0019 0.0208
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0368 0.0347 0.0346
Echinococcus multilocularis thioredoxin glutathione reductase 0.0145 0.0114 0.1049
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.034 0.0317 0.3637
Schistosoma mansoni adam (A disintegrin and metalloprotease 0.0072 0.0038 0.034
Loa Loa (eye worm) thioredoxin reductase 0.0145 0.0114 0.1303
Leishmania major hypothetical protein, conserved 0.0037 0.0002 0.0003
Schistosoma mansoni ADAMTS5 peptidase (M12 family) 0.0195 0.0167 0.1525
Loa Loa (eye worm) jmjC domain-containing protein 0.024 0.0213 0.2437
Trichomonas vaginalis glutathione reductase, putative 0.005 0.0015 1
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0183 0.0153 0.1402
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0843 0.0842 0.7732
Schistosoma mansoni ADAM17 peptidase (M12 family) 0.0414 0.0395 0.362
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.0012 0.0112
Echinococcus multilocularis Blood coagulation inhibitor, Disintegrin 0.026 0.0234 0.2148
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.0012 0.0129
Loa Loa (eye worm) matrixin family protein 0.0405 0.0385 0.4425
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0331 0.0308 0.0307
Echinococcus multilocularis jumonji domain containing protein 0.0161 0.0131 0.1206
Echinococcus multilocularis lysine specific demethylase 5A 0.014 0.0109 0.1004
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Schistosoma mansoni lipoxygenase 0.0468 0.0451 0.4136
Trypanosoma cruzi Peptide deformylase 2, putative 0.3673 0.3793 1
Schistosoma mansoni hypothetical protein 0.009 0.0057 0.0511
Echinococcus granulosus adam 17 protease 0.0455 0.0438 0.4021
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0038 0.0002 0.0004
Trypanosoma cruzi Peptide deformylase 2, putative 0.3673 0.3793 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0003 0.0018
Brugia malayi Matrixin family protein 0.0183 0.0153 0.3608
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.0012 0.0112
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0002 0.0012
Schistosoma mansoni jumonji domain containing protein 0.0302 0.0278 0.2545
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0116 0.0084 0.0763
Echinococcus granulosus lipoxygenase domain containing protein 0.034 0.0317 0.2914
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0186 0.0157 0.1444
Echinococcus multilocularis jumonji domain containing 1A 0.0037 0.0002 0.0018
Plasmodium vivax glutathione reductase, putative 0.0145 0.0114 0.0113
Loa Loa (eye worm) matrix metalloproteinase 0.0183 0.0153 0.1754
Onchocerca volvulus 0.0183 0.0153 0.3965
Mycobacterium leprae PROBABLE HYDROLASE 0.0223 0.0195 0.0194
Treponema pallidum polypeptide deformylase (def) 0.9626 1 1
Brugia malayi Matrixin family protein 0.0183 0.0153 0.3608
Echinococcus granulosus geminin 0.0176 0.0146 0.1346
Echinococcus multilocularis RUN 0.034 0.0317 0.2914
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.9626 1 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0331 0.0308 0.0307
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.005 0.0015 0.0038
Schistosoma mansoni protein phosphatase 2C 0.0037 0.0002 0.0009
Brugia malayi glutathione reductase 0.0145 0.0114 0.268
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.001 0.0088
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0038 0.0002 0.0004
Brugia malayi Bromodomain containing protein 0.0038 0.0002 0.0036
Echinococcus granulosus lipoxygenase domain containing protein 0.034 0.0317 0.2914
Schistosoma mansoni hypothetical protein 0.0259 0.0233 0.2134
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.005 0.0015 0.0132
Echinococcus multilocularis peregrin 0.0118 0.0086 0.0793
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.001 0.008
Echinococcus granulosus lysine specific demethylase 5A 0.0142 0.0111 0.1023
Toxoplasma gondii PHD-finger domain-containing protein 0.0116 0.0084 0.0083
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.038 0.0359 0.33
Brugia malayi RNA, U transporter 1 0.009 0.0057 0.1332
Schistosoma mansoni hypothetical protein 0.034 0.0317 0.2907
Brugia malayi jmjC domain containing protein 0.0037 0.0002 0.0024
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.005 0.0015 0.0014
Plasmodium vivax multidomain scavenger receptor, putative 0.034 0.0317 0.0316
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.001 0.0088
Echinococcus multilocularis geminin 0.0176 0.0146 0.1346
Leishmania major polypeptide deformylase-like protein, putative 0.3673 0.3793 1
Loa Loa (eye worm) reprolysin 0.0041 0.0006 0.0057
Brugia malayi jmjC domain containing protein 0.0037 0.0002 0.0024
Schistosoma mansoni dihydroceramide desaturase 0.0041 0.0006 0.0046
Plasmodium falciparum glutathione reductase 0.005 0.0015 0.0013
Brugia malayi hypothetical protein 0.034 0.0317 0.7482
Loa Loa (eye worm) hypothetical protein 0.0047 0.0012 0.0129
Loa Loa (eye worm) hypothetical protein 0.007 0.0036 0.0403
Plasmodium falciparum LCCL domain-containing protein 0.034 0.0317 0.0315
Echinococcus multilocularis PHD finger protein rhinoceros 0.0116 0.0084 0.077
Echinococcus granulosus adam 0.0072 0.0038 0.0348
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0047 0.0012 0.0293
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0141 0.011 0.1005
Brugia malayi Bromodomain containing protein 0.0118 0.0086 0.202
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.005 0.0015 0.0014
Toxoplasma gondii thioredoxin reductase 0.0145 0.0114 0.0113
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0037 0.0002 0.0003
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.3673 0.3793 1
Plasmodium falciparum thioredoxin reductase 0.005 0.0015 0.0013
Echinococcus granulosus phd:f box containing protein 0.0037 0.0002 0.0018
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0037 0.0002 0.0009
Echinococcus multilocularis adam 17 protease 0.0414 0.0395 0.3625
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0037 0.0001 0.0011
Mycobacterium ulcerans peptide deformylase 0.9626 1 1
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.0019 0.0174
Echinococcus granulosus snurportin 1 0.034 0.0317 0.2913
Trypanosoma brucei trypanothione reductase 0.0145 0.0114 0.0299
Schistosoma mansoni hypothetical protein 0.0176 0.0146 0.1339
Schistosoma mansoni lipoxygenase 0.1079 0.1088 1
Loa Loa (eye worm) hypothetical protein 0.034 0.0317 0.3638
Trypanosoma brucei RNA helicase, putative 0.009 0.0057 0.0147
Toxoplasma gondii hypothetical protein 0.9626 1 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0001 0.0008
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.005 0.0015 0.0038
Echinococcus granulosus Polycystic kidney disease protein 0.034 0.0317 0.2914
Onchocerca volvulus Alhambra homolog 0.0116 0.0084 0.2157
Onchocerca volvulus 0.034 0.0317 0.8223
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Echinococcus granulosus thioredoxin glutathione reductase 0.0145 0.0114 0.1049
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.0025 0.0226
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.005 0.0015 0.0013
Toxoplasma gondii PHD-finger domain-containing protein 0.0116 0.0084 0.0083
Loa Loa (eye worm) hypothetical protein 0.0054 0.0019 0.0208
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.001 0.008
Echinococcus multilocularis JmjC domain containing protein 4 0.0037 0.0002 0.0018
Brugia malayi jmjC domain containing protein 0.0037 0.0002 0.0024
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.005 0.0015 0.0038
Schistosoma mansoni polycystin 1-related 0.034 0.0317 0.2908
Echinococcus granulosus PHD finger protein rhinoceros 0.0116 0.0084 0.077
Schistosoma mansoni loxhd1 0.034 0.0317 0.2908
Mycobacterium tuberculosis Probable oxidoreductase 0.0368 0.0347 0.0346
Loa Loa (eye worm) hypothetical protein 0.0116 0.0084 0.0954
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.005 0.0015 0.0014
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0037 0.0002 0.0003
Echinococcus multilocularis phd:f box containing protein 0.0037 0.0002 0.0018
Brugia malayi F/Y-rich N-terminus family protein 0.004 0.0004 0.0082
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.005 0.0015 0.0013
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.005 0.0015 0.0038
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.0019 0.0166
Mycobacterium tuberculosis Possible exported protein 0.0497 0.0481 0.048
Brugia malayi jmjC domain containing protein 0.0142 0.0111 0.2612
Loa Loa (eye worm) hypothetical protein 0.0042 0.0007 0.0069
Plasmodium falciparum thioredoxin reductase 0.0145 0.0114 0.0112
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.005 0.0015 0.0141
Echinococcus multilocularis disintegrin and metalloproteinase 0.0041 0.0006 0.0054
Brugia malayi hypothetical protein 0.0072 0.0038 0.0875
Schistosoma mansoni rab6-interacting 0.034 0.0317 0.2908
Loa Loa (eye worm) PHD-finger family protein 0.0116 0.0084 0.0954
Echinococcus multilocularis subfamily M12B unassigned peptidase 0.0041 0.0006 0.0054
Toxoplasma gondii PHD-finger domain-containing protein 0.0038 0.0002 0.0001
Echinococcus multilocularis snurportin 1 0.034 0.0317 0.2913
Brugia malayi mbt repeat family protein 0.0047 0.0012 0.0266
Loa Loa (eye worm) hypothetical protein 0.034 0.0317 0.3638
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0145 0.0114 0.0113
Mycobacterium ulcerans hydrolase 0.0223 0.0195 0.0194
Brugia malayi PHD-finger family protein 0.0116 0.0084 0.1963
Toxoplasma gondii NADPH-glutathione reductase 0.005 0.0015 0.0014
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.038 0.0359 0.33
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0002 0.0012
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.001 0.0088
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0041 0.0006 0.0046
Onchocerca volvulus 0.0047 0.0012 0.0293
Schistosoma mansoni hypothetical protein 0.0287 0.0263 0.2406
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0331 0.0308 0.0307
Trypanosoma cruzi trypanothione reductase, putative 0.0145 0.0114 0.0299
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.9626 1 1
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0037 0.0001 0.0011
Onchocerca volvulus Matrilysin homolog 0.0405 0.0385 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.001 0.0088
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Echinococcus granulosus lysine specific demethylase 6a 0.0037 0.0002 0.0018
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0001 0.0008
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.005 0.0015 0.0014
Loa Loa (eye worm) hypothetical protein 0.0037 0.0002 0.0012
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0014 0.0305
Loa Loa (eye worm) hypothetical protein 0.087 0.087 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.005 0.0015 0.0038
Brugia malayi hypothetical protein 0.034 0.0317 0.7482
Mycobacterium ulcerans flavoprotein disulfide reductase 0.005 0.0015 0.0014
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.0012 0.0112
Loa Loa (eye worm) jmjC domain-containing protein 0.0142 0.0111 0.127
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.1079 0.1088 1
Echinococcus granulosus jumonji domain containing 1A 0.0037 0.0002 0.0018
Giardia lamblia PHD finger protein 15 0.0116 0.0084 1
Brugia malayi Disintegrin family protein 0.0041 0.0006 0.0118
Echinococcus multilocularis Polycystic kidney disease protein 0.034 0.0317 0.2914
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0002 0.0012
Schistosoma mansoni phosphatidylserine receptor 0.0037 0.0002 0.0009
Trypanosoma brucei Peptide deformylase 2 0.3673 0.3793 1
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0037 0.0002 0.0003
Echinococcus granulosus peregrin 0.0118 0.0086 0.0793
Leishmania major acetoin dehydrogenase e3 component-like protein 0.005 0.0015 0.0038
Brugia malayi jmjC domain containing protein 0.038 0.0359 0.8476
Leishmania major dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0014 0.0148
Onchocerca volvulus Matrix metalloproteinase homolog 0.0405 0.0385 1
Mycobacterium tuberculosis Probable reductase 0.0331 0.0308 0.0307
Schistosoma mansoni jumonji/arid domain-containing protein 0.0142 0.0111 0.1015
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.001 0.01
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0012 0.0103
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0223 0.0195 0.459
Schistosoma mansoni hypothetical protein 0.034 0.0317 0.2908
Loa Loa (eye worm) hypothetical protein 0.0199 0.017 0.1949
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0002 0.0001
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.0019 0.0174
Loa Loa (eye worm) hypothetical protein 0.0183 0.0153 0.1754
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.005 0.0015 0.0141
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0368 0.0347 0.0346
Schistosoma mansoni jumonji/arid domain-containing protein 0.0142 0.0111 0.1015
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0019 0.0428
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.005 0.0015 0.0038
Schistosoma mansoni bromodomain containing protein 0.0063 0.0028 0.0252
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Plasmodium vivax thioredoxin reductase, putative 0.0145 0.0114 0.0113
Loa Loa (eye worm) hypothetical protein 0.004 0.0004 0.004
Plasmodium falciparum phd finger protein, putative 0.0116 0.0084 0.0082
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0233 0.0206 0.0205
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0038 0.0002 0.0014
Loa Loa (eye worm) matrixin family protein 0.0442 0.0424 0.4863
Schistosoma mansoni jumonji domain containing protein 0.0037 0.0002 0.0009
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.9626 1 1
Echinococcus multilocularis adam 0.0072 0.0038 0.0348
Loa Loa (eye worm) doublecortin family protein 0.034 0.0317 0.3638
Loa Loa (eye worm) hypothetical protein 0.0183 0.0153 0.1754
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0186 0.0157 0.1444
Brugia malayi jmjC domain containing protein 0.0037 0.0002 0.0024
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.3673 0.3793 1
Schistosoma mansoni rab6-interacting 0.034 0.0317 0.2908
Brugia malayi mbt repeat family protein 0.0047 0.0012 0.0266
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.0012 0.0103
Loa Loa (eye worm) hypothetical protein 0.004 0.0005 0.0047
Plasmodium vivax peptide deformylase, putative 0.9626 1 1
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0664 0.0656 0.6024
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0037 0.0002 0.0001
Echinococcus granulosus RUN 0.034 0.0317 0.2914
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.0012 0.0112
Onchocerca volvulus Matrilysin homolog 0.0183 0.0153 0.3965
Loa Loa (eye worm) glutathione reductase 0.0145 0.0114 0.1303
Plasmodium falciparum glutathione reductase 0.0145 0.0114 0.0112
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.005 0.0015 0.0038
Echinococcus granulosus subfamily M12B unassigned peptidase 0.0041 0.0006 0.0054
Plasmodium vivax hypothetical protein, conserved 0.0116 0.0084 0.0083
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0331 0.0308 0.0307
Brugia malayi Hemopexin family protein 0.0259 0.0233 0.5492
Loa Loa (eye worm) hypothetical protein 0.0041 0.0006 0.0057
Echinococcus granulosus arachidonate 5 lipoxygenase 0.1079 0.1088 1
Brugia malayi PHD-finger family protein 0.004 0.0004 0.0082
Schistosoma mansoni hypothetical protein 0.0038 0.0002 0.0014
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0331 0.0308 0.0307
Echinococcus granulosus jumonji domain containing protein 0.0161 0.0131 0.1206
Brugia malayi Matrixin family protein 0.0183 0.0153 0.3608
Echinococcus granulosus disintegrin and metalloproteinase 0.0041 0.0006 0.0054
Trichomonas vaginalis mercuric reductase, putative 0.005 0.0015 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0002 0.0012
Brugia malayi Matrixin family protein 0.0183 0.0153 0.3608
Onchocerca volvulus 0.0259 0.0233 0.6036
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0223 0.0195 0.0194
Brugia malayi Thioredoxin reductase 0.0145 0.0114 0.268
Onchocerca volvulus 0.034 0.0317 0.8223
Trypanosoma brucei Polypeptide deformylase 1 0.3673 0.3793 1
Brugia malayi Bromodomain containing protein 0.0074 0.004 0.0934
Toxoplasma gondii WD domain, G-beta repeat-containing protein 0.0038 0.0002 0.0001
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.001 0.008
Echinococcus multilocularis lipoxygenase domain containing protein 0.034 0.0317 0.2914
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0037 0.0002 0.0001
Brugia malayi metalloprotease disintegrin 16 with thrombospondin type I motif 0.0195 0.0167 0.3923
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.0019 0.0174
Echinococcus granulosus Blood coagulation inhibitor Disintegrin 0.026 0.0234 0.2148
Echinococcus granulosus JmjC domain containing protein 4 0.0037 0.0002 0.0018
Plasmodium falciparum peptide deformylase 0.9626 1 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.0025 0.0226
Trypanosoma cruzi trypanothione reductase, putative 0.005 0.0015 0.0038
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0014 0.0305
Echinococcus granulosus a disintegrin and metalloproteinase with 0.0195 0.0167 0.1532
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.005 0.0015 0.0014
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.001 0.0206
Loa Loa (eye worm) hypothetical protein 0.0183 0.0153 0.1754
Brugia malayi Doublecortin family protein 0.034 0.0317 0.7482
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0012 0.0103
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.005 0.0015 0.0014
Echinococcus multilocularis lipoxygenase domain containing protein 0.034 0.0317 0.2914
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0039 0.0004 0.0036
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0368 0.0347 0.0346
Echinococcus multilocularis lysine specific demethylase 6a 0.0037 0.0002 0.0018
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.005 0.0015 0.0341
Schistosoma mansoni phd/f-box containing protein 0.0037 0.0002 0.0009
Leishmania major dihydrolipoamide dehydrogenase, putative 0.005 0.0015 0.0038
Mycobacterium tuberculosis Probable dehydrogenase 0.0331 0.0308 0.0307
Schistosoma mansoni hypothetical protein 0.0116 0.0084 0.0763
Schistosoma mansoni hypothetical protein 0.0176 0.0146 0.1339
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0041 0.0006 0.0046
Brugia malayi Matrixin family protein 0.0442 0.0424 1
Echinococcus multilocularis a disintegrin and metalloproteinase with 0.0195 0.0167 0.1532
Loa Loa (eye worm) hypothetical protein 0.0049 0.0014 0.0148
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.0019 0.0174
Brugia malayi AF-10 protein 0.0038 0.0002 0.0035
Plasmodium vivax JmjC domain containing protein 0.0037 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0223 0.0195 0.2232
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0664 0.0656 0.6024

Activities

Activity type Activity value Assay description Source Reference
Cell viability (functional) = 35.8 % Percent viability of rat hippocampal neurons exposed to hydrogen peroxide (50 microM) in the presence of the test agent (5 microM) ChEMBL. 8487263
ED20 (functional) = 1 mg kg-1 Hypotensive effect in anesthetized normotensive rat expressed as effective dose ChEMBL. 8487263
Inhibition (functional) = 73.3 % Percent inhibition of 2,2'-azobis(2-amidinopropane)dihydrochloride induced decay of (R)-phycoerythrin fluorescence emission ChEMBL. 8487263
MIC (functional) = 10 uM Inhibition of iron-dependent peroxidation of rabbit vesicular membrane lipids (minimum test concentration that gave greater than 50% inhibition). ChEMBL. 8487263

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.