Detailed information for compound 68174

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 253.253 | Formula: C15H11NO3
  • H donors: 1 H acceptors: 3 LogP: 3.27 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)c1ccc2c(c1)nc(c1c2cccc1)O
  • InChi: 1S/C15H11NO3/c1-19-15(18)9-6-7-11-10-4-2-3-5-12(10)14(17)16-13(11)8-9/h2-8H,1H3,(H,16,17)
  • InChiKey: VBQPUTKXPMHSTC-UHFFFAOYSA-N  

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 poly (ADP-ribose) polymerase 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis poly (ADP ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus poly ADP ribose polymerase 1 Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus poly (ADP ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128423 All targets in OG5_128423
Brugia malayi WGR domain containing protein Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum Poly [ADP-ribose] polymerase 2-A, putative Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus WGR domain containing protein Get druggable targets OG5_128423 All targets in OG5_128423
Trypanosoma brucei poly(adp-ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus multilocularis poly (ADP ribose) polymerase 1 Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum Poly [ADP-ribose] polymerase 2, putative Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma mansoni poly [ADP-ribose] polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative Get druggable targets OG5_128423 All targets in OG5_128423
Neospora caninum hypothetical protein Get druggable targets OG5_128423 All targets in OG5_128423
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus poly adp ribose polymerase 2 Get druggable targets OG5_128423 All targets in OG5_128423
Trypanosoma congolense poly(ADP-ribose) polymerase, putative Get druggable targets OG5_128423 All targets in OG5_128423
Trypanosoma brucei gambiense poly(ADP-ribose) polymerase, putative Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma mansoni poly [ADP-ribose] polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma mansoni poly [ADP-ribose] polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum ko:K00774 NAD ADP-ribosyltransferase [EC2.4.2.30], putative Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum Poly [ADP-ribose] polymerase 1, putative Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus poly (ADP ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Entamoeba histolytica poly(ADP-ribose) polymerase, putative Get druggable targets OG5_128423 All targets in OG5_128423
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum Poly [ADP-ribose] polymerase 2, putative Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus multilocularis poly (adp ribose) polymerase 2 Get druggable targets OG5_128423 All targets in OG5_128423
Echinococcus granulosus poly (ADP ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Brugia malayi WGR domain containing protein Get druggable targets OG5_128423 All targets in OG5_128423
Entamoeba histolytica hypothetical protein Get druggable targets OG5_128423 All targets in OG5_128423
Loa Loa (eye worm) poly(ADP-ribose) polymerase Get druggable targets OG5_128423 All targets in OG5_128423
Schistosoma japonicum Poly [ADP-ribose] polymerase 1, putative Get druggable targets OG5_128423 All targets in OG5_128423

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 multilocularis beta LACTamase domain containing family member 0.0042 0.0591 0.0591
Echinococcus multilocularis poly (ADP ribose) polymerase 0.004 0.0538 0.0538
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Echinococcus granulosus beta-adrenergic receptor kinase 0.0023 0.0138 0.0138
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0023 0.0138 0.0138
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0591 0.094
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0036 0.0036
Echinococcus multilocularis regulator of G protein signaling 0.0023 0.0138 0.0138
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0039 0.051 0.0847
Mycobacterium tuberculosis Conserved protein 0.0042 0.0591 0.0142
Onchocerca volvulus 0.0042 0.0591 0.078
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0022 0.0125 0.0208
Trypanosoma brucei poly(adp-ribose) polymerase 0.0095 0.184 0.5035
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0022 0.0125 0.0125
Brugia malayi follicle stimulating hormone receptor 0.0273 0.6016 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0269 0.5907 0.9438
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0147 0.3054 0.3054
Echinococcus multilocularis regulator of G protein signaling 3 0.0023 0.0138 0.0138
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Brugia malayi A-kinase anchor protein 10, precursor 0.0023 0.0138 0.023
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0422 0.0532
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0022 0.0125 0.0125
Onchocerca volvulus 0.0035 0.0422 0.0498
Schistosoma mansoni thyroid hormone receptor 0.0159 0.3331 0.4197
Echinococcus multilocularis 6 phosphofructokinase 0.0129 0.2632 0.2632
Plasmodium falciparum thioredoxin reductase 0.0039 0.051 0.0487
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) LGC-31 protein 0.0022 0.0125 0.0208
Toxoplasma gondii hypothetical protein 0.0081 0.1507 0.3931
Plasmodium falciparum thioredoxin reductase 0.0111 0.2217 1
Mycobacterium ulcerans 6-phosphofructokinase 0.0129 0.2632 1
Schistosoma mansoni hypothetical protein 0.0018 0.0036 0.0046
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Brugia malayi 6-phosphofructokinase 0.0129 0.2635 0.438
Loa Loa (eye worm) glutathione reductase 0.0111 0.2217 0.3685
Brugia malayi PXA domain containing protein 0.0023 0.0138 0.023
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0036 0.0036
Brugia malayi RNA recognition motif domain containing protein 0.0074 0.134 0.2227
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0111 0.2217 0.2985
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0022 0.0125 0.0158
Echinococcus multilocularis regulator of G protein signaling 7 0.0023 0.0138 0.0138
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0036 0.0061
Loa Loa (eye worm) hypothetical protein 0.0035 0.0422 0.0702
Schistosoma mansoni hypothetical protein 0.0018 0.0036 0.0046
Schistosoma mansoni carbonic anhydrase 0.0081 0.1507 0.1899
Echinococcus multilocularis Regulator of G protein signaling 20 0.0023 0.0138 0.0138
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0039 0.051 0.0487
Echinococcus granulosus carbonic anhydrase 0.0081 0.1507 0.1507
Echinococcus granulosus WGR domain containing protein 0.0054 0.0868 0.0868
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Echinococcus multilocularis carbonic anhydrase 0.0081 0.1507 0.1507
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0022 0.0125 0.0125
Echinococcus granulosus tar DNA binding protein 0.0074 0.134 0.134
Brugia malayi Cation transporter family protein 0.0022 0.0125 0.0208
Toxoplasma gondii thioredoxin reductase 0.0111 0.2217 0.5784
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0138 0.0174
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0022 0.0125 0.0208
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0254 0.5564 0.8837
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0422 0.0532
Schistosoma mansoni hypothetical protein 0.004 0.0538 0.0678
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0039 0.051 0.1395
Mycobacterium tuberculosis Conserved protein 0.0042 0.0591 0.0142
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0022 0.0125 0.0208
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0147 0.3054 0.3054
Echinococcus granulosus glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Trichomonas vaginalis phosphofructokinase, putative 0.0129 0.2632 0.4186
Brugia malayi WGR domain containing protein 0.0095 0.184 0.3059
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0039 0.051 0.1395
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0283 0.6229 1
Toxoplasma gondii NADPH-glutathione reductase 0.0039 0.051 0.133
Brugia malayi phosphofructokinase 0.0129 0.2632 0.4374
Schistosoma mansoni hypothetical protein 0.0018 0.0036 0.0046
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0022 0.0125 0.0208
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Loa Loa (eye worm) ACC-1 protein 0.0022 0.0125 0.0208
Schistosoma mansoni z-protein (S1r protein) 0.0023 0.0138 0.0174
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0138 0.0174
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0129 0.2632 1
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0022 0.0125 0.0208
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0173 0.3654 0.6074
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Mycobacterium tuberculosis Probable reductase 0.0254 0.5564 0.8837
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0058 0.097 0.1613
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0081 0.1507 0.2505
Echinococcus granulosus geminin 0.0198 0.4247 0.4247
Echinococcus granulosus regulator of G protein signaling 3 0.0023 0.0138 0.0138
Schistosoma mansoni tar DNA-binding protein 0.0074 0.134 0.1689
Trypanosoma brucei DNA repair protein, putative 0.0023 0.0136 0.0371
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Echinococcus granulosus poly (ADP ribose) polymerase 0.0027 0.0236 0.0236
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.0591 0.1617
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0022 0.0125 0.0208
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0022 0.0125 0.0208
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.0422 0.1102
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.018 0.3833 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0422 0.0532
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0022 0.0125 0.0125
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0129 0.2632 0.7201
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0039 0.051 0.1395
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.097 0.1613
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0022 0.0125 0.0125
Schistosoma mansoni hypothetical protein 0.006 0.1021 0.1287
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0035 0.0422 0.8283
Echinococcus multilocularis carbonic anhydrase 0.0081 0.1507 0.1507
Mycobacterium tuberculosis Probable hydrolase 0.0042 0.0591 0.0142
Treponema pallidum NADH oxidase 0.0039 0.051 0.0396
Echinococcus granulosus glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0035 0.0422 0.1101
Echinococcus granulosus nAChR subunit 0.0022 0.0125 0.0125
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0138 0.0174
Echinococcus multilocularis glycine receptor subunit beta 0.0022 0.0125 0.0125
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0023 0.0138 0.0174
Leishmania major hypothetical protein, conserved 0.0023 0.0136 0.0371
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0081 0.1507 0.2505
Toxoplasma gondii 6-phosphofructokinase 0.0035 0.0422 0.1101
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0138 0.0174
Entamoeba histolytica phosphofructokinase, putative 0.0129 0.2632 0.7163
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.0095 0.184 0.5035
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0022 0.0125 0.0125
Trypanosoma brucei carbonic anhydrase-like protein 0.0173 0.3654 1
Toxoplasma gondii phosphofructokinase PFKII 0.0035 0.0422 0.1101
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0022 0.0125 0.0125
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Trypanosoma brucei Poly(ADP-ribose) polymerase and DNA-Ligase Zn-finger region/Zinc-finger (CX5CX6HX5H) motif containing protein, putative 0.0023 0.0136 0.0371
Loa Loa (eye worm) RNA binding protein 0.0074 0.134 0.2227
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0081 0.1507 0.2505
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Plasmodium falciparum carbonic anhydrase 0.0081 0.1507 0.6043
Loa Loa (eye worm) hypothetical protein 0.0132 0.2702 0.4491
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0035 0.0422 0.1149
Entamoeba histolytica hypothetical protein 0.0023 0.0138 0.0376
Schistosoma mansoni axis inhibition protein axin 0.0023 0.0138 0.0174
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0591 0.1617
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0173 0.3654 0.6074
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0591 0.076
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0138 0.0174
Leishmania major carbonic anhydrase-like protein 0.0173 0.3654 1
Plasmodium falciparum glutathione reductase 0.0039 0.051 0.0487
Trichomonas vaginalis glutathione reductase, putative 0.0039 0.051 0.0624
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Brugia malayi PXA domain containing protein 0.0023 0.0138 0.023
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Entamoeba histolytica hypothetical protein 0.0027 0.0236 0.0643
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0022 0.0125 0.0125
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0039 0.051 0.1395
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0129 0.2632 0.371
Loa Loa (eye worm) ACC-1 protein 0.0022 0.0125 0.0208
Plasmodium vivax thioredoxin reductase, putative 0.0111 0.2217 1
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0022 0.0125 0.0158
Brugia malayi Pre-SET motif family protein 0.0035 0.0422 0.0702
Echinococcus granulosus regulator of G protein signaling 7 0.0023 0.0138 0.0138
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0042 0.0591 0.0142
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0022 0.0125 0.0125
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Loa Loa (eye worm) hypothetical protein 0.0081 0.1507 0.2505
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0022 0.0125 0.0125
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Brugia malayi WGR domain containing protein 0.0174 0.3674 0.6107
Trichomonas vaginalis phosphofructokinase, putative 0.0129 0.2632 0.4186
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0591 0.0744
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0422 0.0422
Schistosoma mansoni axis inhibition protein axin 0.0023 0.0138 0.0174
Echinococcus granulosus carbonic anhydrase 0.0081 0.1507 0.1507
Loa Loa (eye worm) hypothetical protein 0.0018 0.0036 0.0061
Echinococcus granulosus 6 phosphofructokinase 0.0129 0.2632 0.2632
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0254 0.5564 0.8837
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.0591 0.0982
Brugia malayi Regulator of G protein signaling domain containing protein 0.0023 0.0138 0.023
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0173 0.3654 0.6074
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Brugia malayi TAR-binding protein 0.0074 0.134 0.2227
Mycobacterium tuberculosis Probable lipase LipE 0.0042 0.0591 0.0142
Loa Loa (eye worm) hypothetical protein 0.0023 0.0136 0.0225
Loa Loa (eye worm) phosphofructokinase 0.0129 0.2632 0.4374
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0039 0.051 0.1395
Onchocerca volvulus DNA ligase 3 homolog 0.0023 0.0136 0.0018
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Mycobacterium tuberculosis Probable oxidoreductase 0.0283 0.6229 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0243 0.5307 0.8822
Echinococcus multilocularis thyroid hormone receptor alpha 0.0159 0.3331 0.3331
Mycobacterium tuberculosis Probable dehydrogenase 0.0254 0.5564 0.8837
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0039 0.051 0.051
Mycobacterium ulcerans beta-lactamase 0.0042 0.0591 0.0383
Brugia malayi hypothetical protein 0.0023 0.0138 0.023
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0129 0.2632 0.362
Echinococcus multilocularis regulator of G protein signaling 7 0.0023 0.0138 0.0138
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0022 0.0125 0.0208
Brugia malayi Cation transporter family protein 0.0022 0.0125 0.0208
Brugia malayi RNA binding protein 0.0074 0.134 0.2227
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0173 0.3654 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0022 0.0125 0.0208
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Echinococcus multilocularis beta adrenergic receptor kinase 0.0023 0.0138 0.0138
Echinococcus granulosus glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Schistosoma mansoni poly [ADP-ribose] polymerase 0.0095 0.184 0.2318
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0283 0.6229 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0036 0.0061
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0036 0.0061
Schistosoma mansoni thyroid hormone receptor 0.0159 0.3331 0.4197
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0022 0.0125 0.0158
Leishmania major ATP-dependent phosphofructokinase 0.0129 0.2632 0.7201
Schistosoma mansoni poly [ADP-ribose] polymerase 0.0082 0.1538 0.1938
Brugia malayi hypothetical protein 0.0023 0.0138 0.023
Trypanosoma cruzi DNA repair protein, putative 0.0023 0.0136 0.0371
Leishmania major trypanothione reductase 0.0111 0.2217 0.6067
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0039 0.051 1
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0028 0.0269 0.0448
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Schistosoma mansoni hypothetical protein 0.0081 0.1507 0.1899
Plasmodium vivax glutathione reductase, putative 0.0111 0.2217 1
Mycobacterium tuberculosis Conserved protein 0.0042 0.0591 0.0142
Echinococcus granulosus GPCR family 2 0.0018 0.0036 0.0036
Echinococcus granulosus carbonic anhydrase II 0.0173 0.3654 0.3654
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0039 0.051 0.0487
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.0095 0.184 0.5035
Echinococcus granulosus axis inhibition protein axin 0.0023 0.0138 0.0138
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0022 0.0125 0.0158
Leishmania major hypothetical protein, conserved 0.0042 0.0591 0.1617
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0173 0.3654 0.4605
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0422 0.0532
Brugia malayi beta-lactamase 0.0042 0.0591 0.0982
Echinococcus multilocularis axis inhibition protein axin 0.0023 0.0138 0.0138
Entamoeba histolytica phosphofructokinase, putative 0.0129 0.2632 0.7163
Echinococcus granulosus poly (ADP ribose) polymerase 0.0027 0.0236 0.0236
Brugia malayi regulator of G-protein signaling rgs-7 0.0023 0.0138 0.023
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.0591 0.0982
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0022 0.0125 0.0125
Brugia malayi glutathione reductase 0.0111 0.2217 0.3685
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.0591 0.0591
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0022 0.0125 0.0158
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0591 0.076
Echinococcus granulosus poly adp ribose polymerase 2 0.0095 0.184 0.184
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) hypothetical protein 0.0023 0.0138 0.023
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0022 0.0125 0.0208
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0039 0.051 0.5
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.0591 0.0383
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.097 0.1613
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0591 0.076
Loa Loa (eye worm) hypothetical protein 0.0081 0.1507 0.2505
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0254 0.5564 0.8837
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0022 0.0125 0.0125
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0591 0.0744
Brugia malayi beta-lactamase family protein 0.0042 0.0591 0.0982
Loa Loa (eye worm) RGS-3 protein 0.0023 0.0138 0.023
Loa Loa (eye worm) 6-phosphofructokinase 0.0129 0.2632 0.4374
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0042 0.0591 0.0142
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0022 0.0125 0.0125
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Schistosoma mansoni hypothetical protein 0.0198 0.4247 0.5352
Trichomonas vaginalis set domain proteins, putative 0.0277 0.6095 1
Loa Loa (eye worm) 6-phosphofructokinase 0.0129 0.2632 0.4374
Loa Loa (eye worm) PXA domain-containing protein 0.0023 0.0138 0.023
Trypanosoma cruzi trypanothione reductase, putative 0.0111 0.2217 0.6067
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0273 0.6016 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0591 0.076
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0036 0.0036
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0039 0.051 0.1395
Trichomonas vaginalis phosphofructokinase, putative 0.0129 0.2632 0.4186
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0022 0.0125 0.0208
Mycobacterium tuberculosis Probable esterase LipL 0.0042 0.0591 0.0142
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0022 0.0125 0.0208
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.0422 0.0422
Trypanosoma brucei trypanothione reductase 0.0111 0.2217 0.6067
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0039 0.051 0.5
Echinococcus multilocularis regulator of G protein signaling 3 0.0023 0.0138 0.0138
Brugia malayi excitatory GABA receptor EXP-1A 0.0022 0.0125 0.0208
Schistosoma mansoni hypothetical protein 0.0147 0.3054 0.3848
Loa Loa (eye worm) hypothetical protein 0.0081 0.1507 0.2505
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Schistosoma mansoni 6-phosphofructokinase 0.0129 0.2632 0.3316
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0039 0.051 0.0487
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0023 0.0138 0.023
Echinococcus multilocularis poly (ADP ribose) polymerase 1 0.0174 0.3674 0.3674
Schistosoma mansoni nAChR subunit 0.0022 0.0125 0.0158
Loa Loa (eye worm) beta-lactamase 0.0042 0.0591 0.0982
Echinococcus multilocularis glycine receptor subunit beta 0.0022 0.0125 0.0125
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0022 0.0125 0.0208
Trichomonas vaginalis phosphofructokinase, putative 0.0129 0.2632 0.4186
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0138 0.0174
Echinococcus granulosus glycine receptor subunit beta 0.0022 0.0125 0.0125
Entamoeba histolytica phosphofructokinase, putative 0.0129 0.2632 0.7163
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.097 0.1613
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Echinococcus granulosus Regulator of G protein signaling 20 0.0023 0.0138 0.0138
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0028 0.0269 0.0448
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0081 0.1507 0.2505
Echinococcus multilocularis carbonic anhydrase II 0.0173 0.3654 0.3654
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Echinococcus multilocularis carbonic anhydrase 0.0081 0.1507 0.1507
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Echinococcus granulosus poly (ADP ribose) polymerase 0.0027 0.0236 0.0236
Schistosoma mansoni poly [ADP-ribose] polymerase 0.0174 0.3674 0.4629
Mycobacterium ulcerans hypothetical protein 0.0042 0.0591 0.0383
Onchocerca volvulus 0.0042 0.0591 0.078
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0039 0.051 0.0487
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0023 0.0138 0.023
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0023 0.0138 0.0174
Echinococcus granulosus regulator of G protein signaling 3 0.0023 0.0138 0.0138
Plasmodium vivax SET domain protein, putative 0.0035 0.0422 0.0001
Brugia malayi Pre-SET motif family protein 0.0243 0.5307 0.8822
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0022 0.0125 0.0125
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.051 0.1395
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0034 0.0392 0.0392
Echinococcus granulosus carbonic anhydrase 0.0081 0.1507 0.1507
Echinococcus multilocularis expressed protein 0.0443 1 1
Leishmania major DNA repair protein, putative 0.0023 0.0136 0.0371
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.0422 0.0422
Echinococcus granulosus poly (ADP ribose) polymerase 0.0054 0.0868 0.0868
Loa Loa (eye worm) poly(ADP-ribose) polymerase 0.0068 0.1208 0.2008
Echinococcus granulosus regulator of G protein signaling 7 0.0023 0.0138 0.0138
Entamoeba histolytica hypothetical protein 0.0023 0.0138 0.0376
Schistosoma mansoni carbonic anhydrase-related 0.0081 0.1507 0.1899
Onchocerca volvulus 0.0042 0.0591 0.078
Brugia malayi Regulator of G protein signaling domain containing protein 0.0023 0.0138 0.023
Echinococcus multilocularis nAChR subunit 0.0022 0.0125 0.0125
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0422 0.0477
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0039 0.051 0.1395
Schistosoma mansoni hypothetical protein 0.0198 0.4247 0.5352
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0039 0.051 0.051
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0022 0.0125 0.0208
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0022 0.0125 0.0158
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0023 0.0138 0.0174
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0173 0.3654 1
Schistosoma mansoni tar DNA-binding protein 0.0074 0.134 0.1689
Schistosoma mansoni tar DNA-binding protein 0.0074 0.134 0.1689
Schistosoma mansoni carbonic anhydrase-related 0.0081 0.1507 0.1899
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.0591 0.0383
Mycobacterium tuberculosis Probable lipase LipD 0.0042 0.0591 0.0142
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0023 0.0138 0.023
Echinococcus multilocularis axis inhibition protein axin 0.0023 0.0138 0.0138
Trypanosoma cruzi Poly(ADP-ribose) polymerase and DNA-Ligase Zn-finger region/Zinc-finger (CX5CX6HX5H) motif containing protein, putative 0.0023 0.0136 0.0371
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0081 0.1507 0.2505
Schistosoma mansoni carbonic anhydrase-related 0.0081 0.1507 0.1899
Loa Loa (eye worm) hypothetical protein 0.0095 0.184 0.3059
Brugia malayi 6-phosphofructokinase 0.0129 0.2632 0.4374
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0039 0.051 0.1395
Onchocerca volvulus 0.0277 0.6095 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0039 0.051 0.133
Loa Loa (eye worm) thioredoxin reductase 0.0111 0.2217 0.3685
Trichomonas vaginalis mercuric reductase, putative 0.0039 0.051 0.0624
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0042 0.0591 0.0142
Loa Loa (eye worm) hypothetical protein 0.004 0.0538 0.0894
Entamoeba histolytica hypothetical protein 0.0023 0.0138 0.0376
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0022 0.0125 0.0208
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0254 0.5564 0.8837
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0138 0.0174
Entamoeba histolytica poly(ADP-ribose) polymerase, putative 0.0174 0.3674 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0254 0.5564 0.882
Trichomonas vaginalis esterase, putative 0.0042 0.0591 0.076
Plasmodium falciparum glutathione reductase 0.0111 0.2217 1
Giardia lamblia NADH oxidase lateral transfer candidate 0.0039 0.051 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0039 0.051 0.1395
Echinococcus multilocularis geminin 0.0198 0.4247 0.4247
Echinococcus multilocularis GPCR, family 2 0.0018 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Loa Loa (eye worm) TAR-binding protein 0.0074 0.134 0.2227
Brugia malayi beta-lactamase family protein 0.0042 0.0591 0.0982
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0283 0.6229 1
Toxoplasma gondii ABC1 family protein 0.0042 0.0591 0.1541
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0129 0.2632 0.7201
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0022 0.0125 0.0125
Loa Loa (eye worm) hypothetical protein 0.0042 0.0591 0.0982
Echinococcus multilocularis poly (adp ribose) polymerase 2 0.0095 0.184 0.184
Brugia malayi Cation transporter family protein 0.0022 0.0125 0.0208
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0591 0.1617
Loa Loa (eye worm) hypothetical protein 0.0022 0.0125 0.0208
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0591 0.076
Mycobacterium ulcerans lipase LipD 0.0042 0.0591 0.0383
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0138 0.0174
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.0538 0.0894
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0074 0.134 0.2227
Schistosoma mansoni tar DNA-binding protein 0.0074 0.134 0.1689
Echinococcus granulosus glycine receptor subunit beta 0.0022 0.0125 0.0125
Echinococcus granulosus poly ADP ribose polymerase 1 0.0174 0.3674 0.3674
Echinococcus granulosus axis inhibition protein axin 0.0023 0.0138 0.0138
Echinococcus multilocularis thioredoxin glutathione reductase 0.0111 0.2217 0.2217
Brugia malayi regulator of G-protein signaling egl-10 0.0023 0.0138 0.023
Schistosoma mansoni 6-phosphofructokinase 0.0129 0.2632 0.3316
Brugia malayi Thioredoxin reductase 0.0111 0.2217 0.3685
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0023 0.0138 0.023
Echinococcus multilocularis tar DNA binding protein 0.0074 0.134 0.134
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0023 0.0138 0.0138
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0022 0.0125 0.0125
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0022 0.0125 0.0208
Echinococcus granulosus thioredoxin glutathione reductase 0.0111 0.2217 0.2217
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0081 0.1507 0.2505
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0039 0.051 0.0642
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0035 0.0422 0.0477
Schistosoma mansoni hypothetical protein 0.0018 0.0036 0.0046
Loa Loa (eye worm) carbonic anhydrase 3 0.0173 0.3654 0.6074
Schistosoma mansoni tar DNA-binding protein 0.0074 0.134 0.1689
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0173 0.3654 0.4605

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.184 uM Inhibitory concentration against purified recombinant human Poly (ADP-ribose) polymerase 1 ChEMBL. 11425538
IC50 (binding) = 0.184 uM Inhibitory concentration against purified recombinant human Poly (ADP-ribose) polymerase 1 ChEMBL. 11425538

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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