Detailed information for compound 1075379

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 241.285 | Formula: C15H15NO2
  • H donors: 2 H acceptors: 2 LogP: 2.39 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: ONC(=O)CC(c1ccccc1)c1ccccc1
  • InChi: 1S/C15H15NO2/c17-15(16-18)11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14,18H,11H2,(H,16,17)
  • InChiKey: KJWWMOZTYMOMEU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens histone deacetylase 7 Starlite/ChEMBL References
Homo sapiens histone deacetylase 5 Starlite/ChEMBL References
Homo sapiens histone deacetylase 4 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Theileria parva hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania braziliensis histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Theileria parva hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus granulosus histone deacetylase Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus multilocularis histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania major histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium berghei histone deacetylase 2, putative Get druggable targets OG5_126654 All targets in OG5_126654
Loa Loa (eye worm) histone deacetylase Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania mexicana histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma brucei gambiense histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Brugia malayi Histone deacetylase family protein Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium vivax histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Cryptosporidium parvum histone deactylase of possible bacterial origin with ankyrin repeats at the N-terminus Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania infantum histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma mansoni histone deacetylase 4 5 Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania mexicana histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania donovani histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma congolense histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Babesia bovis histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Theileria parva histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Brugia malayi Histone deacetylase family protein Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus multilocularis histone deacetylase Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus granulosus histone deacetylase 7 Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 6, putative Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium knowlesi histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma congolense histone deacetylase 4 Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma brucei histone deacetylase 3 Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium vivax histone deacetylase 2, putative Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania donovani histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium yoelii Histone deacetylase family, putative Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum IPR000286,Histone deacetylase superfamily;IPR013838,Beta tubulin, autoregulation binding site,domain-containing Get druggable targets OG5_126654 All targets in OG5_126654
Candida albicans strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma cruzi histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma mansoni histone deacetylase hda2 Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus multilocularis histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania major histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 4, putative Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma mansoni histone deacetylase 4 5 Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma congolense histone deacetylase 4 Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 6, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma brucei histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium falciparum histone deacetylase 2 Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus multilocularis histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Loa Loa (eye worm) histone deacetylase 7A Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania braziliensis histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Candida albicans strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma brucei histone deacetylase 4 Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus granulosus histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium knowlesi histone deacetylase 2, putative Get druggable targets OG5_126654 All targets in OG5_126654
Neospora caninum hypothetical protein Get druggable targets OG5_126654 All targets in OG5_126654
Leishmania infantum histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium berghei histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus granulosus histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Plasmodium falciparum histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 10, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma cruzi histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Trypanosoma cruzi histone deacetylase, putative Get druggable targets OG5_126654 All targets in OG5_126654
Toxoplasma gondii histone deacetylase HDAC1 Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus granulosus histone deacetylase 6 Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 10, putative Get druggable targets OG5_126654 All targets in OG5_126654
Echinococcus multilocularis histone deacetylase 7 Get druggable targets OG5_126654 All targets in OG5_126654
Schistosoma japonicum Histone deacetylase 4, putative Get druggable targets OG5_126654 All targets in OG5_126654
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 caspase 2 0.0319 0.1999 0.8384
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Loa Loa (eye worm) cytochrome P450 family protein 0.0454 0.2999 0.2991
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Trypanosoma brucei metacaspase 5, putative 0.0152 0.0758 0.2497
Trypanosoma brucei metacaspase MCA2 0.0152 0.0758 0.2497
Schistosoma mansoni histone deacetylase 4 5 0.017 0.0895 0.3759
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0259 0.1557 0.49
Trypanosoma brucei metacaspase MCA3 0.0152 0.0758 0.2497
Echinococcus multilocularis histone deacetylase 0.017 0.0895 0.3728
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Loa Loa (eye worm) histone deacetylase 0.017 0.0895 0.0885
Plasmodium vivax hypothetical protein, conserved 0.0152 0.0758 0.8443
Loa Loa (eye worm) hypothetical protein 0.0329 0.2076 0.2066
Echinococcus multilocularis lamin dm0 0.0055 0.0038 0.0111
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0157 0.0796 0.2625
Brugia malayi Cytochrome P450 family protein 0.0616 0.4201 0.4201
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0259 0.1557 0.49
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0259 0.1557 1
Loa Loa (eye worm) CYP4Cod1 0.0454 0.2999 0.2991
Echinococcus multilocularis survival motor neuron protein 1 0.0243 0.1437 0.6013
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0259 0.1557 0.5172
Plasmodium falciparum metacaspase-like protein 0.0152 0.0758 0.8443
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0194 0.107 0.5541
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0157 0.0796 0.5076
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0259 0.1557 0.49
Schistosoma mansoni aldehyde dehydrogenase 0.0244 0.1445 0.6065
Mycobacterium leprae putative cytochrome p450 0.0259 0.1557 0.5
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0194 0.107 0.3544
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0259 0.1557 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0259 0.1557 1
Schistosoma mansoni caspase-3 (C14 family) 0.0371 0.2382 1
Trypanosoma brucei cytochrome P450, putative 0.0454 0.2999 1
Echinococcus granulosus lamin 0.0055 0.0038 0.0111
Schistosoma mansoni intermediate filament proteins 0.0055 0.0038 0.016
Loa Loa (eye worm) hypothetical protein 0.0261 0.1567 0.1557
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0112 0.0466 0.1521
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0259 0.1557 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.0515 0.0504
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Mycobacterium ulcerans aldehyde dehydrogenase 0.0244 0.1445 0.4504
Brugia malayi MAP kinase sur-1 0.0157 0.0796 0.0796
Brugia malayi Cytochrome P450 family protein 0.0454 0.2999 0.2999
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0157 0.0796 0.2625
Trichomonas vaginalis ap endonuclease, putative 0.0112 0.0466 0.2922
Trypanosoma cruzi metacaspase 5, putative 0.0152 0.0758 0.2497
Schistosoma mansoni histone deacetylase hda2 0.0051 0.0012 0.0049
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0261 0.1567 0.5206
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0259 0.1557 0.49
Echinococcus granulosus histone deacetylase 6 0.017 0.0895 0.3728
Schistosoma mansoni ap endonuclease 0.0112 0.0466 0.1957
Trichomonas vaginalis CMGC family protein kinase 0.0157 0.0796 0.5043
Echinococcus multilocularis lamin 0.0055 0.0038 0.0111
Plasmodium vivax histone deacetylase, putative 0.017 0.0895 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0244 0.1445 0.4504
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0244 0.1445 0.6046
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0112 0.0466 0.1917
Brugia malayi histone deacetylase 11 0.0051 0.0012 0.0012
Schistosoma mansoni histone deacetylase 4 5 0.017 0.0895 0.3759
Mycobacterium leprae Conserved hypothetical protein 0.0259 0.1557 0.5
Trypanosoma brucei histone deacetylase 3 0.017 0.0895 0.2958
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase 0.0371 0.2382 1
Plasmodium vivax metacaspase 1, putative 0.0152 0.0758 0.8443
Trypanosoma brucei protein kinase, putative 0.0157 0.0796 0.2625
Loa Loa (eye worm) cytochrome P450 0.0259 0.1557 0.1547
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Brugia malayi PAS domain containing protein 0.0098 0.036 0.036
Echinococcus multilocularis caspase 8 0.0152 0.0758 0.3148
Trypanosoma cruzi cytochrome P450, putative 0.0454 0.2999 1
Loa Loa (eye worm) hypothetical protein 0.0194 0.1074 0.1064
Echinococcus multilocularis mitogen activated protein kinase 0.0157 0.0796 0.3309
Brugia malayi Histone deacetylase family protein 0.017 0.0895 0.0895
Toxoplasma gondii aldehyde dehydrogenase 0.0244 0.1445 0.9275
Onchocerca volvulus 0.0167 0.0873 0.4367
Trypanosoma brucei histone deacetylase 4 0.017 0.0895 0.2958
Onchocerca volvulus 0.0073 0.0171 0.0855
Echinococcus granulosus survival motor neuron protein 1 0.0243 0.1437 0.6013
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0152 0.0758 0.4829
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0259 0.1557 1
Echinococcus multilocularis histone deacetylase 7 0.017 0.0895 0.3728
Echinococcus granulosus tumor protein p63 0.0355 0.2264 0.9506
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0259 0.1557 1
Schistosoma mansoni single-minded 0.0098 0.036 0.1513
Schistosoma mansoni aryl hydrocarbon receptor 0.0098 0.036 0.1513
Brugia malayi Cell death protein 3 precursor 0.0319 0.1999 0.1999
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0259 0.1557 0.49
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0261 0.1567 0.1567
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0194 0.107 0.107
Echinococcus multilocularis caspase 3 0.0219 0.1256 0.525
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0166 0.0863 0.0852
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0259 0.1557 0.49
Schistosoma mansoni caspase-7 (C14 family) 0.0319 0.1999 0.8392
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0259 0.1557 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0259 0.1557 0.49
Echinococcus granulosus apoptotic protease activating factor 1 0.0167 0.0873 0.3634
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0112 0.0466 0.1044
Trichomonas vaginalis conserved hypothetical protein 0.0261 0.1567 1
Giardia lamblia Kinase, CMGC MAPK 0.0157 0.0796 0.5043
Schistosoma mansoni aldehyde dehydrogenase 0.0244 0.1445 0.6065
Echinococcus granulosus histone deacetylase 7 0.017 0.0895 0.3728
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0244 0.1445 0.6046
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0259 0.1557 0.49
Onchocerca volvulus Cell death protein 3 homolog 0.0319 0.1999 1
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0194 0.107 0.4494
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0259 0.1557 1
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0261 0.1567 1
Leishmania major cytochrome p450-like protein 0.0259 0.1557 0.5172
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0261 0.1567 0.5206
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0194 0.107 0.4467
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0112 0.0466 0.2922
Echinococcus granulosus intermediate filament protein 0.0055 0.0038 0.0111
Onchocerca volvulus 0.0055 0.0038 0.019
Echinococcus multilocularis histone deacetylase 6 0.017 0.0895 0.3728
Trypanosoma cruzi metacaspase 5, putative 0.0152 0.0758 0.2497
Loa Loa (eye worm) hypothetical protein 0.0052 0.0017 0.0006
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0194 0.107 0.4467
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0261 0.1567 0.6561
Trypanosoma cruzi metacaspase, putative 0.0152 0.0758 0.2497
Leishmania major histone deacetylase, putative 0.017 0.0895 0.2958
Loa Loa (eye worm) hypothetical protein 0.0119 0.0515 0.0504
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0157 0.0796 0.2625
Leishmania major cytochrome p450-like protein 0.0259 0.1557 0.5172
Plasmodium falciparum histone deacetylase 2 0.017 0.0895 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0454 0.2999 0.2991
Echinococcus granulosus caspase 8 0.0152 0.0758 0.3148
Schistosoma mansoni cytochrome P450 0.0259 0.1557 0.6536
Schistosoma mansoni cellular tumor antigen P53 0.0052 0.0017 0.0072
Loa Loa (eye worm) hypothetical protein 0.0167 0.0873 0.0862
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0261 0.1567 1
Echinococcus granulosus cytochrome P450 2K1 0.0259 0.1557 0.6519
Trypanosoma cruzi histone deacetylase, putative 0.017 0.0895 0.2958
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0261 0.1567 0.6561
Trypanosoma cruzi cytochrome P450, putative 0.0454 0.2999 1
Schistosoma mansoni histone deacetylase hda2 0.017 0.0895 0.3759
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0152 0.0758 0.4829
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0194 0.107 0.318
Brugia malayi hypoxia-induced factor 1 0.0304 0.1886 0.1886
Echinococcus multilocularis ubiquitin specific protease 41 0.0261 0.1567 0.6561
Trypanosoma cruzi histone deacetylase, putative 0.017 0.0895 0.2958
Echinococcus granulosus mitogen activated protein kinase 0.0157 0.0796 0.3309
Trypanosoma cruzi metacaspase, putative 0.0152 0.0758 0.2497
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0244 0.1445 0.8973
Loa Loa (eye worm) hypothetical protein 0.0152 0.0758 0.0747
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Brugia malayi Cytochrome P450 family protein 0.0259 0.1557 0.1557
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0157 0.0796 0.2625
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0157 0.0796 0.0785
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0112 0.0466 0.5
Schistosoma mansoni hypothetical protein 0.0167 0.0873 0.3665
Brugia malayi hypothetical protein 0.0329 0.2076 0.2076
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0259 0.1557 0.5172
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0259 0.1557 1
Echinococcus granulosus histone deacetylase 0.017 0.0895 0.3728
Loa Loa (eye worm) hypothetical protein 0.0054 0.0031 0.0019
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0259 0.1557 0.49
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Trichomonas vaginalis ap endonuclease, putative 0.0112 0.0466 0.2922
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0259 0.1557 0.49
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0152 0.0758 0.4829
Echinococcus granulosus histone deacetylase 6 0.017 0.0895 0.3728
Brugia malayi intermediate filament protein 0.0055 0.0038 0.0038
Loa Loa (eye worm) cytochrome P450 family protein 0.0616 0.4201 0.4194
Echinococcus granulosus single minded 2 0.0073 0.0171 0.0672
Brugia malayi hypothetical protein 0.0243 0.1437 0.1437
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0112 0.0466 0.1521
Echinococcus multilocularis tumor protein p63 0.0355 0.2264 0.9506
Trypanosoma cruzi metacaspase, putative 0.0152 0.0758 0.2497
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0194 0.107 0.318
Brugia malayi mucosa associated lymphoid tissue lymphoma translocation protein 1 0.0152 0.0758 0.0758
Brugia malayi exodeoxyribonuclease III family protein 0.0112 0.0466 0.0466
Plasmodium falciparum histone deacetylase, putative 0.017 0.0895 1
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Trypanosoma brucei metacaspase 0.0152 0.0758 0.2497
Brugia malayi Histone deacetylase family protein 0.017 0.0895 0.0895
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0259 0.1557 1
Echinococcus granulosus ubiquitin specific protease 41 0.0261 0.1567 0.6561
Schistosoma mansoni histone deacetylase 0.0051 0.0012 0.0049
Brugia malayi histone deacetylase 3 (HD3) 0.0051 0.0012 0.0012
Loa Loa (eye worm) hypothetical protein 0.0243 0.1437 0.1427
Schistosoma mansoni subfamily C14A unassigned peptidase (C14 family) 0.0152 0.0758 0.3181
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0244 0.1445 0.4797
Echinococcus multilocularis caspase 0.0371 0.2382 1
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0259 0.1557 0.49
Echinococcus multilocularis transfer RNA-Lys 0.0073 0.0171 0.0672
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0112 0.0466 0.1521
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0112 0.0466 0.0455
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0112 0.0466 0.1521
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0157 0.0796 0.2625
Echinococcus multilocularis histone deacetylase 6 0.017 0.0895 0.3728
Echinococcus multilocularis apoptotic protease activating factor 1 0.0167 0.0873 0.3634
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0259 0.1557 1
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0261 0.1567 0.6578
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0259 0.1557 0.49
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0259 0.1557 0.5172
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0259 0.1557 1
Loa Loa (eye worm) intermediate filament protein 0.0055 0.0038 0.0026
Trypanosoma cruzi metacaspase, putative 0.0152 0.0758 0.2497
Echinococcus granulosus histone deacetylase 6 0.017 0.0895 0.3728
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0259 0.1557 0.5172
Echinococcus granulosus caspase 0.0371 0.2382 1
Schistosoma mansoni serine/threonine protein kinase 0.0157 0.0796 0.3342
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0055 0.0038 0.0026
Treponema pallidum exodeoxyribonuclease (exoA) 0.0112 0.0466 0.5
Schistosoma mansoni hypothetical protein 0.0259 0.1557 0.6536
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0261 0.1567 0.6561
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0259 0.1557 1
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0259 0.1557 0.49
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0261 0.1567 0.5206
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0261 0.1567 0.5206
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase 0.0371 0.2382 1
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0157 0.0796 0.2625
Schistosoma mansoni lamin 0.0055 0.0038 0.016
Brugia malayi cytochrome P450 0.0259 0.1557 0.1557
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0112 0.0466 0.1917
Brugia malayi Histone deacetylase 1 0.0051 0.0012 0.0012
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0259 0.1557 1
Trichomonas vaginalis CMGC family protein kinase 0.0157 0.0796 0.5043
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0112 0.0466 0.5143
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0259 0.1557 0.49
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0259 0.1557 0.49
Toxoplasma gondii exonuclease III APE 0.0112 0.0466 0.2941
Echinococcus multilocularis 0.0259 0.1557 0.6519
Leishmania major cytochrome p450-like protein 0.0454 0.2999 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0152 0.0758 0.4797
Loa Loa (eye worm) hypoxia-induced factor 1 0.0304 0.1886 0.1877
Plasmodium vivax histone deacetylase 2, putative 0.017 0.0895 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0112 0.0466 0.2922
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0112 0.0466 0.5143
Onchocerca volvulus Histone deacetylase 10 homolog 0.0051 0.0012 0.0058
Loa Loa (eye worm) hypothetical protein 0.0055 0.0038 0.0026
Echinococcus multilocularis histone deacetylase 6 0.017 0.0895 0.3728
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Brugia malayi bHLH-PAS transcription factor 0.0073 0.0171 0.0171
Schistosoma mansoni lamin 0.0055 0.0038 0.016
Brugia malayi Cytochrome P450 family protein 0.0454 0.2999 0.2999
Plasmodium falciparum metacaspase 1 0.0152 0.0758 0.8443
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0261 0.1567 0.6578
Echinococcus granulosus caspase 3 0.0219 0.1256 0.525
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0261 0.1567 1
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0259 0.1557 1
Loa Loa (eye worm) histone deacetylase 7A 0.017 0.0895 0.0885
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0259 0.1557 0.49
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0157 0.0796 0.2625
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0259 0.1557 1
Trichomonas vaginalis CMGC family protein kinase 0.0157 0.0796 0.5043
Onchocerca volvulus 0.0052 0.0017 0.0086
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0259 0.1557 0.49
Onchocerca volvulus 0.0055 0.0038 0.019
Loa Loa (eye worm) hypothetical protein 0.0319 0.1999 0.1989
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0259 0.1557 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0259 0.1557 1
Echinococcus multilocularis musashi 0.0055 0.0038 0.0111
Trypanosoma cruzi histone deacetylase, putative 0.017 0.0895 0.2958
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0259 0.1557 1
Schistosoma mansoni histone deacetylase 0.0051 0.0012 0.0049
Trypanosoma brucei histone deacetylase, putative 0.017 0.0895 0.2958
Trypanosoma brucei Metacaspase-4 0.0152 0.0758 0.2497
Schistosoma mansoni caspase-7 (C14 family) 0.0371 0.2382 1
Brugia malayi Intermediate filament tail domain containing protein 0.0055 0.0038 0.0038
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.0758 0.4797
Toxoplasma gondii histone deacetylase HDAC1 0.017 0.0895 0.5719
Mycobacterium ulcerans aldehyde dehydrogenase 0.0244 0.1445 0.4504
Echinococcus granulosus lamin dm0 0.0055 0.0038 0.0111
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0259 0.1557 0.49
Echinococcus multilocularis caspase 2 0.0319 0.1999 0.8384
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0259 0.1557 1
Trichomonas vaginalis CMGC family protein kinase 0.0157 0.0796 0.5043
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0261 0.1567 0.6561
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0259 0.1557 0.5172
Echinococcus granulosus mitogen activated protein kinase 3 0.0157 0.0796 0.3309
Leishmania major histone deacetylase, putative 0.017 0.0895 0.2958
Echinococcus multilocularis mitogen activated protein kinase 3 0.0157 0.0796 0.3309
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0454 0.2999 1
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0259 0.1557 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0261 0.1567 1
Schistosoma mansoni histone deacetylase 1 2 3 0.0051 0.0012 0.0049
Schistosoma mansoni ap endonuclease 0.0112 0.0466 0.1957
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0259 0.1557 0.49
Leishmania major metacaspase, putative 0.0152 0.0758 0.2497
Brugia malayi histone deacetylase 1 (HD1) 0.0051 0.0012 0.0012
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0259 0.1557 0.49
Brugia malayi hypothetical protein 0.0167 0.0873 0.0873

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 10 uM Inhibition of human recombinant N-terminal FLAG-tagged HDAC7 (438-915) expressed in baculovirus after 10 mins by fluorimetric analysis ChEMBL. 19699639
IC50 (binding) > 10 uM Inhibition of human recombinant N-terminal FLAG-tagged HDAC5 (620-1122) expressed in baculovirus after 10 mins by fluorimetric analysis ChEMBL. 19699639
IC50 (binding) > 10 uM Inhibition of human recombinant N-terminal FLAG-tagged HDAC4 (612-1034) expressed in baculovirus after 10 mins by fluorimetric analysis ChEMBL. 19699639
Inhibition (binding) Inhibition of recombinant C-terminal FLAG-tagged HDAC2 expressed in baculovirus at 20 uM after 10 mins by fluorimetric analysis ChEMBL. 19699639
Inhibition (binding) Inhibition of recombinant C-terminal FLAG-tagged HDAC1 expressed in baculovirus at 20 uM after 10 mins by fluorimetric analysis ChEMBL. 19699639

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.

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