Detailed information for compound 1519341

Basic information

Technical information
  • TDR Targets ID: 1519341
  • Name: (3aR,5aS,8R,9S,9aS,9bR)-2-(2,4-difluorophenyl )-8,9-dihydroxy-4,5,5a,7,8,9,9a,9b-octahydro- 3aH-benzo[e]isoindole-1,3,6-trione
  • MW: 365.328 | Formula: C18H17F2NO5
  • H donors: 2 H acceptors: 5 LogP: -0.03 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(c(c1)F)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1[C@H](O)[C@H](O)CC(=O)[C@H]1CC2
  • InChi: 1S/C18H17F2NO5/c19-7-1-4-11(10(20)5-7)21-17(25)9-3-2-8-12(22)6-13(23)16(24)14(8)15(9)18(21)26/h1,4-5,8-9,13-16,23-24H,2-3,6H2/t8-,9-,13-,14+,15+,16-/m1/s1
  • InChiKey: JACJBRWWWHWFPM-HJLZCGJCSA-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 APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
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
Onchocerca volvulus 0.0092 0.0821 0.1056
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Schistosoma mansoni nAChR subunit 0.0042 0.0098 0.1191
Brugia malayi excitatory GABA receptor EXP-1A 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Trichomonas vaginalis set domain proteins, putative 0.0511 0.6944 1
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0092 0.0821 0.2154
Echinococcus granulosus nAChR subunit 0.0092 0.0821 0.2154
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0123 0.1281 0.1281
Leishmania major C-8 sterol isomerase-like protein 0.072 1 1
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Echinococcus multilocularis nAChR subunit 0.0092 0.0821 0.2154
Onchocerca volvulus 0.0049 0.0202 0.0152
Onchocerca volvulus 0.0049 0.0202 0.0152
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0092 0.0821 0.2154
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0042 0.0098 0.0098
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0092 0.0821 0.2154
Loa Loa (eye worm) hypothetical protein 0.072 1 1
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0049 0.0202 0.0202
Trypanosoma brucei C-8 sterol isomerase, putative 0.072 1 1
Brugia malayi Pre-SET motif family protein 0.0449 0.6038 0.6038
Trypanosoma cruzi Emopamil binding protein, putative 0.0269 0.3409 0.315
Entamoeba histolytica hypothetical protein 0.0049 0.0202 0.5
Brugia malayi Cation transporter family protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0368 0.4856 0.4856
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0092 0.0821 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0064 0.042 0.5112
Brugia malayi hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0042 0.0098 0.0098
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0092 0.0821 1
Brugia malayi hypothetical protein 0.0123 0.1281 0.1281
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0064 0.042 0.5112
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0092 0.0821 0.2154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Brugia malayi hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi Pre-SET motif family protein 0.0064 0.042 0.042
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0092 0.0821 0.2154
Onchocerca volvulus 0.0269 0.3409 0.4837
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0092 0.0821 0.0821
Schistosoma mansoni neurotransmitter gated ion channel 0.0049 0.0202 0.2457
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0049 0.0202 0.2457
Trypanosoma brucei Emopamil binding protein, putative 0.0269 0.3409 0.315
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0272 0.3453 0.3453
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Giardia lamblia Kinase, CMGC MAPK 0.0062 0.0378 0.5
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Trypanosoma cruzi 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0269 0.3409 0.315
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0092 0.0821 0.2154
Onchocerca volvulus 0.0092 0.0821 0.1056
Echinococcus granulosus glycine receptor subunit beta 0.0092 0.0821 0.2154
Loa Loa (eye worm) hypothetical protein 0.0123 0.1281 0.1281
Onchocerca volvulus 0.0092 0.0821 0.1056
Echinococcus multilocularis mitogen activated protein kinase 0.0062 0.0378 0.0835
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0092 0.0821 0.2154
Trypanosoma cruzi Emopamil binding protein, putative 0.0269 0.3409 0.315
Onchocerca volvulus Huntingtin homolog 0.0123 0.1281 0.1728
Onchocerca volvulus 0.0092 0.0821 0.1056
Echinococcus granulosus glycine receptor subunit beta 0.0092 0.0821 0.2154
Trypanosoma cruzi C-8 sterol isomerase, putative 0.072 1 1
Echinococcus multilocularis nAChR subunit 0.0049 0.0202 0.031
Echinococcus multilocularis glycine receptor subunit beta 0.0092 0.0821 0.2154
Schistosoma mansoni acetylcholine receptor subunit beta 0.0042 0.0098 0.1191
Schistosoma mansoni serine/threonine protein kinase 0.0062 0.0378 0.4606
Echinococcus granulosus nAChR subunit 0.0049 0.0202 0.031
Onchocerca volvulus 0.0511 0.6944 1
Plasmodium vivax SET domain protein, putative 0.0064 0.042 0.5
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0062 0.0378 0.0378
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0092 0.0821 0.2154
Echinococcus multilocularis glycine receptor subunit beta 0.0092 0.0821 0.2154
Onchocerca volvulus Putative nachr subunit 0.0092 0.0821 0.1056
Onchocerca volvulus 0.0092 0.0821 0.1056
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0064 0.042 0.5112
Onchocerca volvulus 0.0064 0.042 0.047
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0049 0.0202 0.0202
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0064 0.042 0.5112
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Onchocerca volvulus 0.0092 0.0821 0.1056
Loa Loa (eye worm) ACC-1 protein 0.0092 0.0821 0.0821
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0092 0.0821 0.0821
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0092 0.0821 0.0821
Loa Loa (eye worm) neuronal acetylcholine receptor protein 0.0042 0.0098 0.0098
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0092 0.0821 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi hypothetical protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0092 0.0821 0.0821
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0092 0.0821 1
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0092 0.0821 0.2154
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0092 0.0821 0.0821
Schistosoma mansoni neurotransmitter gated ion channel 0.0042 0.0098 0.1191
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0092 0.0821 0.0821
Echinococcus granulosus mitogen activated protein kinase 0.0062 0.0378 0.0835
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0064 0.042 0.0959
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0062 0.0385 0.0856
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0092 0.0821 0.2154
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0092 0.0821 0.2154
Loa Loa (eye worm) acetylcholine receptor protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Schistosoma mansoni survival motor neuron protein 0.0055 0.0289 0.3527
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0092 0.0821 0.0821
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0049 0.0202 0.0202
Schistosoma mansoni nAChR subunit 0.0042 0.0098 0.1191
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Leishmania major hypothetical protein, conserved 0.0269 0.3409 0.315
Echinococcus multilocularis mitogen activated protein kinase 3 0.0062 0.0378 0.0835
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0092 0.0821 1
Schistosoma mansoni hypothetical protein 0.0055 0.0289 0.3527
Loa Loa (eye worm) LGC-31 protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0449 0.6038 0.6038
Brugia malayi Cation transporter family protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0092 0.0821 0.0821
Leishmania major 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0269 0.3409 0.315
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Echinococcus granulosus glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0092 0.0821 0.2154
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0092 0.0821 0.0821
Echinococcus granulosus mitogen activated protein kinase 3 0.0062 0.0378 0.0835
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0241 0.0241
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Brugia malayi MAP kinase sur-1 0.0062 0.0378 0.0378
Echinococcus granulosus glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Brugia malayi hypothetical protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0241 0.0241
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0092 0.0821 0.0821
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0049 0.0202 0.2457
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0092 0.0821 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Echinococcus granulosus histone lysine methyltransferase setb 0.0064 0.042 0.0959
Echinococcus multilocularis survival motor neuron protein 1 0.0272 0.3453 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0042 0.0098 0.0098
Brugia malayi hypothetical protein 0.0042 0.0098 0.0098
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0241 0.0241
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0049 0.0202 0.0202
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0092 0.0821 0.2154
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0055 0.0289 0.0289
Loa Loa (eye worm) ACC-1 protein 0.0092 0.0821 0.0821
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0064 0.042 0.0959
Loa Loa (eye worm) hypothetical protein 0.0049 0.0202 0.0202
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0092 0.0821 0.2154
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Echinococcus granulosus glycine receptor subunit alpha 1 0.0092 0.0821 0.2154
Loa Loa (eye worm) GABA receptor subunit 0.0049 0.0202 0.0202
Schistosoma mansoni neurotransmitter gated ion channel 0.0042 0.0098 0.1191
Brugia malayi hypothetical protein 0.0272 0.3453 0.3453
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0064 0.042 1
Brugia malayi Acetylcholine receptor protein, alpha-like chain 1 precursor 0.0042 0.0098 0.0098
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.042 0.042
Onchocerca volvulus Huntingtin homolog 0.0123 0.1281 0.1728
Schistosoma mansoni nAChR subunit 0.0092 0.0821 1
Trypanosoma cruzi 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0269 0.3409 0.315
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0092 0.0821 0.0821
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0092 0.0821 0.0821
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0092 0.0821 0.2154
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0092 0.0821 0.0821
Echinococcus granulosus survival motor neuron protein 1 0.0272 0.3453 1
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Schistosoma mansoni acetylcholine receptor-related 0.0042 0.0098 0.1191
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Onchocerca volvulus 0.0055 0.0289 0.028
Brugia malayi Cation transporter family protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821
Loa Loa (eye worm) hypothetical protein 0.0052 0.0241 0.0241
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0042 0.0098 0.0098
Brugia malayi Neuronal acetylcholine receptor protein, alpha-2 chain precursor 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0042 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0092 0.0821 0.0821

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
Potency (functional) 7.9433 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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

No literature references available for this target.

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