Detailed information for compound 434817

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 416.431 | Formula: C26H16N4O2
  • H donors: 0 H acceptors: 3 LogP: 5.42 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccco2)c2c(O1)ccc1c2cccc1
  • InChi: 1S/C26H16N4O2/c1-2-8-17(9-3-1)24-28-25-23-22(19-11-6-14-31-19)21-18-10-5-4-7-16(18)12-13-20(21)32-26(23)27-15-30(25)29-24/h1-15,22H
  • InChiKey: KQILLBSELBWUOK-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
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0017 0.0048 0.0018
Schistosoma mansoni tubulin subunit alpha 0.0169 0.2181 0.2158
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.003 0.5
Entamoeba histolytica hypothetical protein 0.0035 0.0297 0.0237
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Schistosoma mansoni hypothetical protein 0.0152 0.1941 0.1917
Schistosoma mansoni hypothetical protein 0.0328 0.4405 0.4388
Leishmania major zeta tubulin, putative 0.0169 0.2181 0.2158
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0062 0.0032
Schistosoma mansoni hypothetical protein 0.0047 0.0461 0.0432
Mycobacterium ulcerans lipase LipD 0.0035 0.0295 0.1233
Loa Loa (eye worm) tubulin alpha 2 0.0372 0.5014 0.5013
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0041 0.0388 0.0359
Onchocerca volvulus 0.0035 0.0295 0.0449
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0017 0.0048 0.0082
Trypanosoma brucei alpha tubulin 0.0541 0.7389 0.7381
Echinococcus multilocularis musashi 0.0026 0.0172 0.0143
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0105 0.1277 0.4303
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0295 0.0266
Schistosoma mansoni tubulin subunit alpha 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0017 0.0048 0.0061
Brugia malayi hypothetical protein 0.0035 0.0297 0.0294
Brugia malayi Tubulin beta chain 0.0221 0.2901 0.29
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0017 0.0048 0.0082
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0295 0.1233
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0105 0.1277 0.4303
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Schistosoma mansoni ap endonuclease 0.0018 0.0062 0.0032
Mycobacterium ulcerans cell division protein FtsZ 0.0169 0.2181 1
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0017 0.0048 0.0082
Plasmodium vivax thioredoxin reductase, putative 0.0046 0.0451 0.0449
Trypanosoma cruzi tubulin gamma chain 0.039 0.5276 0.5262
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0372 0.5014 0.4999
Trichomonas vaginalis tubulin epsilon chain, putative 0.0169 0.2181 0.2158
Schistosoma mansoni hypothetical protein 0.0022 0.0114 0.0084
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0017 0.0048 0.0018
Leishmania major cytochrome p450-like protein 0.0034 0.0286 0.0257
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Leishmania major cytochrome p450-like protein 0.0017 0.0048 0.0018
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0096 0.0066
Trichomonas vaginalis tubulin, putative 0.0169 0.2181 0.2158
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0295 0.0266
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0295 0.0266
Leishmania major hypothetical protein, conserved 0.0049 0.0492 0.0464
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0017 0.0048 0.0082
Echinococcus granulosus lamin dm0 0.0026 0.0172 0.0143
Loa Loa (eye worm) cytochrome P450 0.0017 0.0048 0.0045
Loa Loa (eye worm) cytochrome P450 family protein 0.0034 0.0286 0.0283
Echinococcus granulosus Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Echinococcus granulosus tubulin alpha chain 0.0541 0.7389 0.7381
Brugia malayi Tubulin alpha chain 0.0169 0.2181 0.2179
Entamoeba histolytica tubulin alpha chain, putative 0.0541 0.7389 0.7373
Loa Loa (eye worm) tubulin beta chain 0.0727 1 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0062 0.0148
Leishmania major gamma-tubulin 0.039 0.5276 0.5262
Leishmania major beta tubulin 0.0727 1 1
Trypanosoma brucei epsilon tubulin 0.039 0.5276 0.5262
Echinococcus granulosus tubulin delta chain 0.0169 0.2181 0.2158
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0295 0.0266
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0062 0.0032
Trypanosoma brucei beta tubulin 0.0727 1 1
Schistosoma mansoni hypothetical protein 0.0328 0.4405 0.4388
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0223 0.2928 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0221 0.2901 0.288
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0034 0.0286 0.119
Loa Loa (eye worm) tubulin beta-1 chain 0.0727 1 1
Leishmania major beta tubulin 0.0727 1 1
Echinococcus granulosus tubulin alpha chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Probable oxidoreductase 0.0117 0.1441 0.4869
Entamoeba histolytica tubulin gamma chain 0.039 0.5276 0.5247
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0017 0.0048 0.0082
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0105 0.1277 0.4303
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0297 0.0268
Trypanosoma cruzi alpha tubulin, putative 0.0541 0.7389 0.7381
Loa Loa (eye worm) glutathione reductase 0.0046 0.0451 0.0449
Echinococcus granulosus tubulin alpha chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Probable reductase 0.0105 0.1277 0.4303
Loa Loa (eye worm) hypothetical protein 0.032 0.4294 0.4293
Loa Loa (eye worm) tubulin alpha-3 chain 0.032 0.4294 0.4293
Loa Loa (eye worm) hypothetical protein 0.0069 0.0767 0.0765
Echinococcus granulosus peroxisome assembly protein 26 0.0541 0.7389 0.7381
Echinococcus granulosus Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0041 0.0388 0.0388
Echinococcus granulosus Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0017 0.0048 0.0061
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0017 0.0048 0.0082
Echinococcus multilocularis lamin 0.0026 0.0172 0.0143
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0096 0.0094
Echinococcus granulosus Tubulin beta 2C chain 0.0727 1 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0062 0.0032
Loa Loa (eye worm) hypothetical protein 0.0229 0.3015 0.3013
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0169 0.2181 0.2158
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0017 0.0048 0.0018
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Plasmodium falciparum thioredoxin reductase 0.0046 0.0451 0.0422
Loa Loa (eye worm) tubulin beta chain 0.0169 0.2181 0.2179
Schistosoma mansoni tubulin subunit delta 0.0169 0.2181 0.2158
Echinococcus granulosus microtubule associated protein 2 0.0668 0.917 0.9168
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0017 0.0048 0.0082
Echinococcus granulosus lamin 0.0026 0.0172 0.0143
Echinococcus multilocularis tubulin alpha chain 0.0541 0.7389 0.7381
Leishmania major beta tubulin 0.0727 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0727 1 1
Echinococcus granulosus tubulin beta 4A class IVa 0.0727 1 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0017 0.0048 0.0048
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Schistosoma mansoni tubulin subunit alpha 0.0541 0.7389 0.7381
Trichomonas vaginalis esterase, putative 0.0035 0.0295 0.0266
Trichomonas vaginalis tubulin beta chain, putative 0.0221 0.2901 0.288
Onchocerca volvulus 0.0048 0.0478 0.1118
Leishmania major beta tubulin 0.0727 1 1
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0017 0.0048 0.0082
Schistosoma mansoni alpha tubulin 0.0541 0.7389 0.7381
Echinococcus granulosus tubulin gamma 1 chain 0.039 0.5276 0.5262
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0062 0.0148
Brugia malayi hypothetical protein 0.0229 0.3015 0.3013
Toxoplasma gondii exonuclease III APE 0.0018 0.0062 0.0062
Giardia lamblia Gamma tubulin 0.039 0.5276 0.5262
Entamoeba histolytica hypothetical protein 0.0035 0.0297 0.0237
Entamoeba histolytica tubulin family protein 0.0727 1 1
Loa Loa (eye worm) tubulin alpha chain 0.0541 0.7389 0.7389
Echinococcus granulosus tubulin alpha 1C chain 0.0541 0.7389 0.7381
Leishmania major beta tubulin 0.0727 1 1
Entamoeba histolytica hypothetical protein 0.0035 0.0297 0.0237
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0295 0.0266
Echinococcus granulosus intermediate filament protein 0.0026 0.0172 0.0143
Leishmania major trypanothione reductase 0.0046 0.0451 0.0422
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0016 0.003 0.003
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0017 0.0048 0.0061
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0017 0.0048 0.0061
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0016 0.003 0.0028
Trichomonas vaginalis tubulin epsilon chain, putative 0.0541 0.7389 0.7381
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Brugia malayi beta-lactamase 0.0035 0.0295 0.0293
Echinococcus multilocularis survival motor neuron protein 1 0.0229 0.3015 0.2994
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0017 0.0048 0.0082
Plasmodium vivax glutathione reductase, putative 0.0046 0.0451 0.0449
Schistosoma mansoni cytochrome P450 0.0017 0.0048 0.0018
Echinococcus multilocularis small conductance calcium activated potassium 0.0152 0.1941 0.1917
Trichomonas vaginalis tubulin gamma chain, putative 0.039 0.5276 0.5262
Leishmania major cytochrome p450-like protein 0.0017 0.0048 0.0018
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0727 1 1
Trichomonas vaginalis tubulin, putative 0.0221 0.2901 0.288
Giardia lamblia Beta tubulin 0.0727 1 1
Trypanosoma brucei beta tubulin 0.0727 1 1
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0017 0.0048 0.0061
Brugia malayi Cytochrome P450 family protein 0.0034 0.0286 0.0283
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0339 0.031
Leishmania major hypothetical protein, conserved 0.0035 0.0295 0.0266
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0062 0.0059
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Brugia malayi hypothetical protein 0.0147 0.1866 0.1864
Schistosoma mansoni lamin 0.0026 0.0172 0.0143
Loa Loa (eye worm) BEN-1 protein 0.0727 1 1
Echinococcus multilocularis beta tubulin 0.0727 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0017 0.0048 0.0061
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0295 0.0266
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0017 0.0048 0.0061
Plasmodium falciparum alpha tubulin 1 0.0541 0.7389 0.7381
Toxoplasma gondii beta-tubulin, putative 0.0727 1 1
Echinococcus multilocularis 0.0017 0.0048 0.0018
Trypanosoma cruzi tubulin delta chain 0.0169 0.2181 0.2158
Loa Loa (eye worm) hypothetical protein 0.0372 0.5014 0.5013
Trichomonas vaginalis tubulin alpha chain, putative 0.0221 0.2901 0.288
Trypanosoma cruzi cytochrome P450, putative 0.0034 0.0286 0.0257
Giardia lamblia Epsilon tubulin 0.0169 0.2181 0.2158
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0062 0.0059
Echinococcus multilocularis Tubulin beta 2C chain 0.0727 1 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0022 0.0114 0.0084
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0295 0.0293
Leishmania major beta tubulin 0.0727 1 1
Trypanosoma brucei zeta tubulin 0.0169 0.2181 0.2158
Trypanosoma brucei beta tubulin 0.0727 1 1
Plasmodium falciparum tubulin beta chain 0.0727 1 1
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0018 0.0061 0.0031
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0172 0.017
Echinococcus multilocularis tubulin beta 1 chain 0.0727 1 1
Loa Loa (eye worm) tubulin beta-2A chain 0.0727 1 1
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.0339 0.031
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0062 0.0032
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0017 0.0048 0.0082
Loa Loa (eye worm) hypothetical protein 0.0541 0.7389 0.7389
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0062 0.0032
Leishmania major beta tubulin 0.0727 1 1
Onchocerca volvulus 0.0035 0.0295 0.0449
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0169 0.2181 0.2181
Leishmania major beta tubulin 0.0727 1 1
Brugia malayi beta-lactamase family protein 0.0035 0.0295 0.0293
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0295 0.1233
Loa Loa (eye worm) alpha-tubulin 0.0541 0.7389 0.7389
Loa Loa (eye worm) tubulin alpha chain 0.0541 0.7389 0.7389
Brugia malayi Tubulin alpha-2 chain 0.0541 0.7389 0.7389
Trichomonas vaginalis tubulin, putative 0.0221 0.2901 0.288
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0295 0.0293
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.003 0.0027
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0169 0.2181 0.2158
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0172 0.017
Entamoeba histolytica tubulin family protein 0.0727 1 1
Trypanosoma brucei alpha tubulin 0.0541 0.7389 0.7381
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Brugia malayi glutathione reductase 0.0046 0.0451 0.0449
Echinococcus multilocularis Tubulin beta 2C chain 0.0727 1 1
Schistosoma mansoni lamin 0.0026 0.0172 0.0143
Trypanosoma brucei alpha tubulin 0.0541 0.7389 0.7381
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0478 0.0449
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0295 0.0915
Echinococcus granulosus Tubulin beta 2C chain 0.0727 1 1
Loa Loa (eye worm) thioredoxin reductase 0.0046 0.0451 0.0449
Plasmodium vivax tubulin alpha chain, putative 0.0541 0.7389 0.7389
Schistosoma mansoni alpha tubulin 0.0541 0.7389 0.7381
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0105 0.1277 0.576
Mycobacterium leprae cell division protein FtsZ 0.0169 0.2181 1
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Loa Loa (eye worm) acetyltransferase 0.0141 0.1782 0.178
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0017 0.0048 0.0061
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0017 0.0048 0.0061
Loa Loa (eye worm) beta-lactamase 0.0035 0.0295 0.0293
Trypanosoma cruzi cytochrome P450, putative 0.0034 0.0286 0.0257
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0062 0.0059
Brugia malayi cytochrome P450 0.0017 0.0048 0.0045
Brugia malayi Tubulin beta chain 0.0169 0.2181 0.2179
Echinococcus multilocularis tubulin alpha 1C chain 0.0541 0.7389 0.7381
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0017 0.0048 0.0082
Mycobacterium tuberculosis Probable dehydrogenase 0.0105 0.1277 0.4303
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0105 0.1277 0.4303
Loa Loa (eye worm) tubulin beta-4 chain 0.0727 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0221 0.2901 0.288
Echinococcus multilocularis tubulin alpha chain 0.0541 0.7389 0.7381
Echinococcus multilocularis tubulin delta chain 0.0169 0.2181 0.2158
Trypanosoma cruzi PAB1-binding protein , putative 0.0049 0.0492 0.0464
Echinococcus granulosus histone acetyltransferase KAT2B 0.0137 0.1727 0.1702
Loa Loa (eye worm) tubulin alpha 2 0.0372 0.5014 0.5013
Echinococcus granulosus tumor protein p63 0.0327 0.4392 0.4375
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0295 0.0915
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0017 0.0048 0.0061
Echinococcus granulosus alpha tubulin 0.0541 0.7389 0.7381
Loa Loa (eye worm) RecQ helicase 0.0021 0.0096 0.0094
Leishmania major beta tubulin 0.0727 1 1
Leishmania major beta tubulin 0.0727 1 1
Onchocerca volvulus 0.0221 0.2901 1
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Toxoplasma gondii LsmAD domain-containing protein 0.0049 0.0492 0.0492
Trichomonas vaginalis tubulin beta chain, putative 0.0541 0.7389 0.7381
Schistosoma mansoni blooms syndrome DNA helicase 0.0016 0.0035 0.0005
Plasmodium vivax tubulin alpha chain, putative 0.0541 0.7389 0.7389
Loa Loa (eye worm) hypothetical protein 0.0152 0.1941 0.1939
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0017 0.0048 0.0082
Leishmania major epsilon tubulin, putative 0.039 0.5276 0.5262
Echinococcus multilocularis Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0541 0.7389 0.7381
Loa Loa (eye worm) tubulin gamma chain 0.039 0.5276 0.5275
Echinococcus multilocularis lamin dm0 0.0026 0.0172 0.0143
Plasmodium falciparum tubulin epsilon chain, putative 0.039 0.5276 0.5262
Brugia malayi Cytochrome P450 family protein 0.0017 0.0048 0.0045
Brugia malayi tubulin alpha-2 chain 0.0541 0.7389 0.7389
Trypanosoma cruzi beta tubulin, putative 0.0727 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0727 1 1
Toxoplasma gondii alpha-tubulin I, putative 0.0541 0.7389 0.7389
Echinococcus granulosus tubulin alpha 0.039 0.5276 0.5262
Brugia malayi Cytochrome P450 family protein 0.0034 0.0286 0.0283
Leishmania major beta tubulin 0.0727 1 1
Echinococcus granulosus tubulin alpha 3 chain 0.0541 0.7389 0.7381
Loa Loa (eye worm) cytochrome P450 family protein 0.0034 0.0286 0.0283
Plasmodium vivax delta tubulin, putative 0.0169 0.2181 0.218
Trypanosoma brucei alpha tubulin 0.0541 0.7389 0.7381
Leishmania major beta tubulin 0.0727 1 1
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0096 0.0066
Echinococcus multilocularis Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0117 0.1441 0.4869
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0169 0.2181 0.2181
Plasmodium falciparum tubulin gamma chain 0.039 0.5276 0.5262
Loa Loa (eye worm) CYP4Cod1 0.0034 0.0286 0.0283
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0022 0.0114 0.0084
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.0874
Brugia malayi hypothetical protein 0.0049 0.0492 0.049
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0017 0.0048 0.0082
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0017 0.0048 0.0061
Mycobacterium tuberculosis Conserved protein 0.0035 0.0295 0.0915
Echinococcus multilocularis tubulin alpha chain 0.0541 0.7389 0.7381
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0017 0.0048 0.0082
Brugia malayi Tubulin gamma chain 0.039 0.5276 0.5275
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0372 0.5014 0.5013
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0062 0.011
Echinococcus multilocularis geminin 0.0328 0.4405 0.4388
Loa Loa (eye worm) tubulin alpha-2 chain 0.0541 0.7389 0.7389
Trichomonas vaginalis tubulin epsilon chain, putative 0.0541 0.7389 0.7381
Brugia malayi tubulin alpha chain - mouse 0.0541 0.7389 0.7389
Trichomonas vaginalis tubulin, putative 0.0727 1 1
Giardia lamblia Alpha-tubulin 0.0541 0.7389 0.7381
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Schistosoma mansoni alpha tubulin 0.0541 0.7389 0.7381
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0117 0.1441 0.4869
Trypanosoma cruzi tubulin delta chain 0.0169 0.2181 0.2158
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Trypanosoma brucei cytochrome P450, putative 0.0034 0.0286 0.0257
Mycobacterium tuberculosis Conserved protein 0.0035 0.0295 0.0915
Schistosoma mansoni intermediate filament proteins 0.0026 0.0172 0.0143
Loa Loa (eye worm) alpha-tubulin 0.0541 0.7389 0.7389
Leishmania major beta tubulin 0.0727 1 1
Schistosoma mansoni tubulin subunit beta 0.0169 0.2181 0.2158
Echinococcus multilocularis tumor protein p63 0.0327 0.4392 0.4375
Trypanosoma cruzi zeta tubulin, putative 0.0169 0.2181 0.2158
Loa Loa (eye worm) hypothetical protein 0.0016 0.0037 0.0035
Echinococcus multilocularis tubulin subunit beta 0.0727 1 1
Trypanosoma brucei tubulin gamma chain 0.039 0.5276 0.5262
Echinococcus granulosus tubulin epsilon chain 0.039 0.5276 0.5262
Leishmania major beta tubulin 0.0727 1 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0046 0.0451 0.0422
Schistosoma mansoni ap endonuclease 0.0018 0.0062 0.0032
Giardia lamblia Delta tubulin 0.0169 0.2181 0.2158
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0297 0.0268
Entamoeba histolytica hypothetical protein 0.0035 0.0297 0.0237
Echinococcus granulosus thioredoxin glutathione reductase 0.0046 0.0451 0.0422
Echinococcus multilocularis tubulin alpha 3 chain 0.0541 0.7389 0.7381
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0295 0.116
Trypanosoma cruzi epsilon tubulin, putative 0.039 0.5276 0.5262
Echinococcus multilocularis microtubule associated protein 2 0.0668 0.917 0.9168
Trichomonas vaginalis tubulin gamma chain, putative 0.039 0.5276 0.5262
Leishmania major beta tubulin 0.0727 1 1
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Echinococcus granulosus survival motor neuron protein 1 0.0229 0.3015 0.2994
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0295 0.0915
Echinococcus multilocularis tubulin epsilon chain 0.039 0.5276 0.5262
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0017 0.0048 0.0018
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0017 0.0048 0.0061
Brugia malayi intermediate filament protein 0.0026 0.0172 0.017
Echinococcus granulosus bloom syndrome protein 0.0021 0.0096 0.0066
Schistosoma mansoni survival motor neuron protein 0.0047 0.0461 0.0432
Brugia malayi Tubulin alpha chain 0.0541 0.7389 0.7389
Echinococcus multilocularis beta tubulin 0.0727 1 1
Giardia lamblia Alpha-tubulin 0.0541 0.7389 0.7381
Echinococcus multilocularis Tubulin beta 2C chain 0.0727 1 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0046 0.0451 0.1453
Plasmodium falciparum ataxin-2 like protein, putative 0.0049 0.0492 0.0464
Trichomonas vaginalis conserved hypothetical protein 0.0169 0.2181 0.2158
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Trichomonas vaginalis tubulin epsilon chain, putative 0.0727 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.032 0.4294 0.4277
Trichomonas vaginalis tubulin epsilon chain, putative 0.0727 1 1
Echinococcus granulosus tubulin alpha 3 chain 0.0541 0.7389 0.7381
Trypanosoma cruzi PAB1-binding protein , putative 0.0049 0.0492 0.0464
Echinococcus granulosus geminin 0.0328 0.4405 0.4388
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0295 0.0915
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0339 0.0279
Giardia lamblia Beta tubulin 0.0727 1 1
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0017 0.0048 0.0061
Brugia malayi hypothetical protein 0.0032 0.0249 0.0247
Onchocerca volvulus 0.0035 0.0295 0.0449
Brugia malayi alpha-tubulin 0.0541 0.7389 0.7389
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0295 0.0266
Echinococcus granulosus histone acetyltransferase KAT2B 0.0041 0.0388 0.0359
Leishmania major beta tubulin 0.0727 1 1
Schistosoma mansoni tubulin subunit gamma 0.039 0.5276 0.5262
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0041 0.0388 0.0385
Leishmania major beta tubulin 0.0727 1 1
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Echinococcus granulosus cytochrome P450 2K1 0.0017 0.0048 0.0018
Treponema pallidum cell division protein FtsZ 0.0169 0.2181 1
Plasmodium falciparum alpha tubulin 2 0.0541 0.7389 0.7381
Schistosoma mansoni microtubule-associated protein tau 0.0668 0.917 0.9168
Trypanosoma brucei beta tubulin 0.039 0.5276 0.5262
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0096 0.0066
Echinococcus granulosus Tubulin beta 2C chain 0.0727 1 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0062 0.0032
Trypanosoma cruzi epsilon tubulin, putative 0.039 0.5276 0.5262
Echinococcus multilocularis tubulin alpha chain 0.0541 0.7389 0.7381
Leishmania major beta tubulin 0.0727 1 1
Giardia lamblia Beta tubulin 0.0727 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.039 0.5276 0.5262
Trypanosoma cruzi zeta tubulin, putative 0.0169 0.2181 0.2158
Echinococcus multilocularis tubulin alpha 3 chain 0.0541 0.7389 0.7381
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0172 0.017
Onchocerca volvulus 0.0047 0.0461 0.1057
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0017 0.0048 0.0082
Echinococcus granulosus tubulin subunit beta 0.0727 1 1
Echinococcus granulosus tubulin beta 1 chain 0.0727 1 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0062 0.0148
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0062 0.0032
Plasmodium vivax tubulin beta chain, putative 0.0727 1 1
Echinococcus granulosus beta tubulin 0.0727 1 1
Echinococcus multilocularis tubulin alpha 0.039 0.5276 0.5262
Mycobacterium ulcerans hypothetical protein 0.0035 0.0295 0.1233
Plasmodium vivax ataxin-2 like protein, putative 0.0049 0.0492 0.049
Loa Loa (eye worm) beta-tubulin 0.0727 1 1
Plasmodium falciparum tubulin delta chain, putative 0.0169 0.2181 0.2158
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0297 0.0268
Echinococcus multilocularis Tubulin beta 2C chain 0.0727 1 1
Loa Loa (eye worm) hypothetical protein 0.0147 0.1866 0.1864
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0169 0.2181 1
Toxoplasma gondii alpha tubulin TUBA1 0.0541 0.7389 0.7389
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0062 0.0032
Brugia malayi beta-lactamase family protein 0.0035 0.0295 0.0293
Trypanosoma brucei beta tubulin 0.0727 1 1
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0017 0.0048 0.0082
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0062 0.0032
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0017 0.0048 0.0082
Echinococcus granulosus tubulin alpha 1C chain 0.0541 0.7389 0.7381
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0017 0.0048 0.0082
Echinococcus granulosus beta tubulin 0.0727 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Toxoplasma gondii NADPH-glutathione reductase 0.0016 0.003 0.003
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0017 0.0048 0.0082
Echinococcus granulosus Tubulin beta 2C chain 0.0727 1 1
Brugia malayi Cytochrome P450 family protein 0.0054 0.0568 0.0565
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0295 0.0266
Schistosoma mansoni tubulin subunit alpha 0.0541 0.7389 0.7381
Entamoeba histolytica tubulin alpha-1 chain 0.0541 0.7389 0.7373
Trypanosoma brucei tubulin delta chain 0.0169 0.2181 0.2158
Leishmania major alpha tubulin 0.0541 0.7389 0.7381
Echinococcus granulosus small conductance calcium activated potassium 0.0152 0.1941 0.1917
Trypanosoma brucei trypanothione reductase 0.0046 0.0451 0.0422
Echinococcus multilocularis Tubulin beta 2C chain 0.0727 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.039 0.5276 0.5276
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0017 0.0048 0.0061
Mycobacterium tuberculosis Cell division protein FtsZ 0.0169 0.2181 0.7425
Mycobacterium leprae Probable lipase LipE 0.0035 0.0295 0.116
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0141 0.1782 0.1758
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0117 0.1441 0.6529
Trichomonas vaginalis bromodomain-containing protein, putative 0.0041 0.0388 0.0359
Echinococcus granulosus tubulin alpha chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0295 0.0915
Plasmodium vivax tubulin epsilon chain, putative 0.039 0.5276 0.5275
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0016 0.003 0.0028
Trypanosoma brucei epsilon tubulin 0.039 0.5276 0.5262
Trichomonas vaginalis tubulin gamma chain, putative 0.0727 1 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0141 0.1782 0.1758
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0017 0.0048 0.0061
Plasmodium falciparum glutathione reductase 0.0046 0.0451 0.0422
Toxoplasma gondii beta tubulin 0.0727 1 1
Leishmania major delta tubulin, putative 0.0169 0.2181 0.2158
Echinococcus multilocularis tubulin gamma 1 chain 0.039 0.5276 0.5262
Brugia malayi Cell division protein ftsZ 0.0169 0.2181 0.2179
Trypanosoma brucei PAB1-binding protein , putative 0.0049 0.0492 0.0464
Loa Loa (eye worm) hypothetical protein 0.0026 0.0166 0.0163
Echinococcus granulosus tubulin alpha chain 0.0541 0.7389 0.7381
Echinococcus multilocularis tubulin alpha chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0017 0.0048 0.0061
Plasmodium falciparum ataxin-2 like protein, putative 0.0049 0.0492 0.0464
Echinococcus multilocularis Tubulin alpha 1 chain 0.0541 0.7389 0.7381
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0017 0.0048 0.0061
Echinococcus multilocularis tubulin alpha 1C chain 0.0541 0.7389 0.7381
Toxoplasma gondii ABC1 family protein 0.0035 0.0295 0.0295
Echinococcus granulosus Tubulin beta 2C chain 0.0727 1 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0295 0.0293
Loa Loa (eye worm) hypothetical protein 0.0026 0.0172 0.017
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0062 0.0032
Loa Loa (eye worm) hypothetical protein 0.0035 0.0295 0.0293
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0295 0.0266
Echinococcus granulosus tubulin subunit TubB 0.0541 0.7389 0.7381
Loa Loa (eye worm) cytochrome P450 family protein 0.0054 0.0568 0.0565
Schistosoma mansoni tubulin subunit beta 0.0727 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0295 0.0266
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0221 0.2901 0.288
Trypanosoma brucei epsilon tubulin 0.039 0.5276 0.5262
Echinococcus multilocularis hypothetical protein 0.0541 0.7389 0.7381
Trypanosoma brucei alpha tubulin, putative 0.0221 0.2901 0.288
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0295 0.0915
Schistosoma mansoni hypothetical protein 0.0017 0.0048 0.0018
Loa Loa (eye worm) tubulin alpha 2 0.0151 0.1919 0.1917
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0041 0.0388 0.0388
Schistosoma mansoni tubulin subunit epsilon 0.039 0.5276 0.5262
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0017 0.0048 0.0061
Loa Loa (eye worm) hypothetical protein 0.0048 0.0478 0.0475
Toxoplasma gondii beta-1 tubulin, putative 0.0727 1 1
Trypanosoma cruzi trypanothione reductase, putative 0.0046 0.0451 0.0422
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0017 0.0048 0.0061
Trichomonas vaginalis tubulin gamma chain, putative 0.0169 0.2181 0.2158
Brugia malayi Thioredoxin reductase 0.0046 0.0451 0.0449
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0295 0.0266
Mycobacterium tuberculosis Conserved protein 0.0035 0.0295 0.0915
Loa Loa (eye worm) hypothetical protein 0.0049 0.0492 0.049
Loa Loa (eye worm) BEN-1 protein 0.0727 1 1
Plasmodium vivax tubulin gamma chain, putative 0.039 0.5276 0.5275
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0042
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0017 0.0048 0.0061
Brugia malayi Tubulin alpha-2 chain 0.0541 0.7389 0.7389
Toxoplasma gondii thioredoxin reductase 0.0046 0.0451 0.0451
Trypanosoma brucei zeta tubulin, putative 0.0169 0.2181 0.2158
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0295 0.0915
Brugia malayi beta-tubulin, identical 0.0727 1 1
Schistosoma mansoni hypothetical protein 0.0035 0.0297 0.0268
Echinococcus multilocularis peroxisome assembly protein 26 0.0541 0.7389 0.7381
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0461 0.0459
Mycobacterium ulcerans beta-lactamase 0.0035 0.0295 0.1233
Schistosoma mansoni calcium-activated potassium channel 0.0145 0.1837 0.1813
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0295 0.0266
Echinococcus multilocularis tubulin subunit TubB 0.0541 0.7389 0.7381
Schistosoma mansoni calcium-activated potassium channel 0.0152 0.1941 0.1917
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0017 0.0048 0.0018
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0017 0.0048 0.0082
Onchocerca volvulus 0.0147 0.1866 0.6207
Brugia malayi acetyltransferase, GNAT family protein 0.0141 0.1782 0.178

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 75 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 50 ug by SOS chromotest ChEMBL. 17224204
Inhibition (functional) = 75 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 50 ug by SOS chromotest ChEMBL. 17224204
Inhibition (functional) = 99 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 2 ug by SOS chromotest ChEMBL. 17224204
Inhibition (functional) = 99 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 10 ug by SOS chromotest ChEMBL. 17224204
Inhibition (functional) = 99 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 2 ug by SOS chromotest ChEMBL. 17224204
Inhibition (functional) = 99 % Inhibition of nifuroxazide-induced genotoxicity in Escherichia coli PQ37 at 10 ug by SOS chromotest ChEMBL. 17224204
Ratio (ADMET) = 1.3 Genotoxicity in Escherichia coli PQ37 assessed as ratio of beta-galactosidase/AP activity in presence and absence of drug at 50 ug ChEMBL. 17224204
Ratio (ADMET) = 1.3 Genotoxicity in Escherichia coli PQ37 assessed as ratio of beta-galactosidase/AP activity in presence and absence of drug at 2 ug ChEMBL. 17224204
Ratio (ADMET) = 1.4 Genotoxicity in Escherichia coli PQ37 assessed as ratio of beta-galactosidase/AP activity in presence and absence of drug at 10 ug ChEMBL. 17224204

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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