Detailed information for compound 1472633

Basic information

Technical information
  • TDR Targets ID: 1472633
  • Name: AQ-405/10984003
  • MW: 269.726 | Formula: C16H12ClNO
  • H donors: 1 H acceptors: 2 LogP: 3.58 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)C(c1nccc2c1cccc2)O
  • InChi: 1S/C16H12ClNO/c17-13-7-5-12(6-8-13)16(19)15-14-4-2-1-3-11(14)9-10-18-15/h1-10,16,19H
  • InChiKey: HKOVMSWNKKIKHC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.7292 1
Echinococcus granulosus Proteasome subunit alpha type 7 0.0034 0.018 0.0129
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0445 0.1171
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0172 0.3271 1
Onchocerca volvulus 0.011 0.1885 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0276 0.0636
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Toxoplasma gondii proteasome subunit beta type 2, putative 0.0082 0.1266 0.3546
Echinococcus granulosus subfamily T1A non peptidase ue 0.0034 0.018 0.0129
Schistosoma mansoni proteasome subunit alpha 6 (T01 family) 0.0034 0.018 0.0333
Loa Loa (eye worm) TAR-binding protein 0.0071 0.1002 0.2926
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0445 0.1171
Echinococcus granulosus death domain containing protein 0.0048 0.0495 0.0514
Brugia malayi Proteasome subunit alpha type 7-1 0.0034 0.018 0.0106
Brugia malayi Sema domain containing protein 0.0046 0.0456 0.0385
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0034 0.018 0.0333
Toxoplasma gondii proteasome subunit beta type 1, putative 0.0133 0.2393 0.7224
Brugia malayi Proteasome A-type and B-type family protein 0.0034 0.018 0.0106
Plasmodium vivax proteasome subunit beta type-5, putative 0.0171 0.3244 1
Plasmodium falciparum proteasome subunit beta type-1, putative 0.0133 0.2393 0.7224
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0082 0.1266 0.1527
Echinococcus granulosus tar DNA binding protein 0.0071 0.1002 0.1132
Echinococcus multilocularis Proteasome, subunit alpha beta 0.0034 0.018 0.0129
Echinococcus multilocularis hypothetical protein 0.0046 0.0456 0.0466
Brugia malayi Sema domain containing protein 0.0046 0.0456 0.0385
Schistosoma mansoni proteasome subunit alpha 4 (T01 family) 0.0034 0.018 0.0333
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Brugia malayi proteasome subunit alpha type 3 0.0034 0.018 0.0106
Plasmodium vivax proteasome subunit beta type-1, putative 0.0133 0.2393 0.7224
Entamoeba histolytica calcium-dependent protein kinase 2, putative 0.0034 0.018 0.0247
Schistosoma mansoni proteasome subunit alpha 7 (T01 family) 0.0034 0.018 0.0333
Schistosoma mansoni hypothetical protein 0.0046 0.0456 0.1205
Entamoeba histolytica proteasome subunit beta type 6 precursor, putative 0.0034 0.018 0.0247
Entamoeba histolytica proteasome subunit beta Type 4 precursor, putative 0.0034 0.018 0.0247
Echinococcus multilocularis proteasome (prosome, macropain) 0.0171 0.3244 0.3868
Schistosoma mansoni tar DNA-binding protein 0.0071 0.1002 0.2926
Trypanosoma cruzi 20S proteasome subunit 0.0082 0.1266 0.3546
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Entamoeba histolytica proteasome subunit alpha type 1, putative 0.0034 0.018 0.0247
Brugia malayi Plexin repeat family protein 0.011 0.1885 0.1824
Schistosoma mansoni proteasome subunit alpha 3 (T01 family) 0.0034 0.018 0.0333
Echinococcus multilocularis 20S proteasome subunit alpha 6 0.0034 0.018 0.0129
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0034 0.018 0.0129
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0082 0.1266 0.1527
Echinococcus granulosus proteasome subunit alpha type 2 0.0034 0.018 0.0129
Echinococcus multilocularis subfamily T1A non peptidase ue 0.0034 0.018 0.0129
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0171 0.3244 1
Schistosoma mansoni proteasome subunit beta 3 (T01 family) 0.0034 0.018 0.0333
Loa Loa (eye worm) proteasome subunit beta type 2 0.0082 0.1266 0.3761
Brugia malayi proteasome subunit alpha type 6 0.0034 0.018 0.0106
Brugia malayi Proteasome subunit alpha type 1 0.0034 0.018 0.0106
Schistosoma mansoni proteasome subunit beta 1 (T01 family) 0.0133 0.2393 0.7316
Schistosoma mansoni semaphorin 5-related 0.0046 0.0456 0.1205
Giardia lamblia Proteasome subunit beta type 5 precursor 0.0171 0.3244 0.4308
Entamoeba histolytica probable proteasome subunit beta type 2, putative 0.0082 0.1266 0.1736
Echinococcus granulosus semaphorin 5B 0.0046 0.0456 0.0466
Echinococcus granulosus netrin receptor unc 5 0.0048 0.0495 0.0514
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0071 0.1002 0.2926
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0034 0.018 0.0333
Entamoeba histolytica proteasome subunit alpha type 4, putative 0.0034 0.018 0.0247
Entamoeba histolytica proteasome subunit alpha type 3, putative 0.0034 0.018 0.0247
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0172 0.3271 1
Echinococcus granulosus proteasome prosome macropain subunit beta type 0.0034 0.018 0.0129
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0445 0.0453
Brugia malayi Protein kinase domain containing protein 0.0048 0.0495 0.0424
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0171 0.3244 1
Schistosoma mansoni hypothetical protein 0.0064 0.0859 0.2477
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Toxoplasma gondii proteasome subunit beta type, putative 0.0171 0.3244 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0056 0.0667 0.0597
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0056 0.0667 0.187
Trypanosoma brucei proteasome subunit beta type-2, putative 0.0082 0.1266 0.3546
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0445 0.0453
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0445 0.1171
Loa Loa (eye worm) proteasome subunit alpha type 6 0.0034 0.018 0.0333
Schistosoma mansoni proteasome catalytic subunit 3 (T01 family) 0.0171 0.3244 1
Echinococcus multilocularis plexin a4 0.013 0.2334 0.2758
Brugia malayi hypothetical protein 0.0046 0.0456 0.0385
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0133 0.2393 0.7224
Echinococcus granulosus Proteasome subunit alpha beta 0.0034 0.018 0.0129
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0034 0.018 0.0333
Schistosoma mansoni tar DNA-binding protein 0.0071 0.1002 0.2926
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0133 0.2393 0.283
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0172 0.3271 1
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0171 0.3244 1
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0082 0.1266 0.1455
Echinococcus granulosus proteasome subunit beta t family 0.0034 0.018 0.0129
Echinococcus multilocularis Ankyrin 0.0048 0.0501 0.0521
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0445 0.1171
Brugia malayi proteasome subunit alpha type 1 0.0034 0.018 0.0106
Brugia malayi proteasome subunit beta type 1 0.0133 0.2393 0.2336
Entamoeba histolytica proteasome subunit alpha type 7, putative 0.0034 0.018 0.0247
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0048 0.0495 0.0514
Trypanosoma brucei proteasome subunit beta type-5, putative 0.0171 0.3244 1
Echinococcus multilocularis proteasome (prosome macropain) subunit beta type 0.0034 0.018 0.0129
Schistosoma mansoni tar DNA-binding protein 0.0071 0.1002 0.2926
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0034 0.018 0.0333
Loa Loa (eye worm) hypothetical protein 0.011 0.1885 0.5713
Schistosoma mansoni proteasome catalytic subunit 1 (T01 family) 0.0034 0.018 0.0333
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0056 0.0667 0.0597
Entamoeba histolytica proteasome subunit alpha type 5, putative 0.0034 0.018 0.0247
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0048 0.0501 0.1346
Echinococcus granulosus Ankyrin 0.0048 0.0501 0.0521
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Loa Loa (eye worm) sema domain-containing protein 0.0046 0.0456 0.1205
Brugia malayi Proteasome A-type and B-type family protein 0.0034 0.018 0.0106
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0276 0.0203
Wolbachia endosymbiont of Brugia malayi ATP-dependent protease peptidase subunit 0.0034 0.018 0.5
Entamoeba histolytica proteasome subunit beta type 3, putative 0.0034 0.018 0.0247
Onchocerca volvulus Netrin receptor homolog 0.0048 0.0495 0.2324
Schistosoma mansoni hypothetical protein 0.0038 0.0276 0.0636
Schistosoma mansoni hypothetical protein 0.0048 0.0495 0.1328
Loa Loa (eye worm) hypothetical protein 0.0056 0.0667 0.187
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Echinococcus granulosus 20S proteasome subunit alpha 6 0.0034 0.018 0.0129
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.7292 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0445 0.0453
Loa Loa (eye worm) 20S proteasome alpha5 subunit 0.0034 0.018 0.0333
Brugia malayi Proteasome A-type and B-type family protein 0.0171 0.3244 0.3193
Echinococcus multilocularis proteasome subunit beta (t family) proteasome (prosome macropain) subunit beta 0.0034 0.018 0.0129
Entamoeba histolytica proteasome subunit alpha type 7, putative 0.0034 0.018 0.0247
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0034 0.018 0.0333
Schistosoma mansoni proteasome subunit beta 4 (T01 family) 0.0034 0.018 0.0333
Entamoeba histolytica proteasome subunit alpha type 6, putative 0.0034 0.018 0.0247
Schistosoma mansoni tar DNA-binding protein 0.0071 0.1002 0.2926
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Schistosoma mansoni plexin 0.011 0.1885 0.5713
Brugia malayi RNA binding protein 0.0071 0.1002 0.0934
Echinococcus granulosus proteasome subunit beta type 7 0.0034 0.018 0.0129
Plasmodium falciparum proteasome subunit beta type-5 0.0171 0.3244 1
Mycobacterium ulcerans proteasome PrcB 0.0171 0.3244 0.9911
Loa Loa (eye worm) PAS-3 protein 0.0034 0.018 0.0333
Trypanosoma brucei proteasome beta 6 subunit 0.0133 0.2393 0.7224
Brugia malayi Death domain containing protein 0.0048 0.0495 0.0424
Leishmania major proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative 0.0133 0.2393 0.7224
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0133 0.2393 0.7224
Leishmania major proteasome beta 2 subunit, putative 0.0082 0.1266 0.3546
Echinococcus multilocularis proteasome subunit alpha type 2 0.0034 0.018 0.0129
Schistosoma mansoni plexin 0.0064 0.0859 0.2477
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0048 0.0495 0.0514
Echinococcus granulosus semaphorin 1A 0.0046 0.0456 0.0466
Brugia malayi proteasome subunit beta type 3 0.0034 0.018 0.0106
Giardia lamblia Fructose-bisphosphate aldolase 0.0353 0.7292 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0048 0.0495 0.1328
Echinococcus multilocularis proteasome subunit alpha type 6 0.0034 0.018 0.0129
Entamoeba histolytica proteasome subunit alpha type 4, putative 0.0034 0.018 0.0247
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0082 0.1266 0.3761
Treponema pallidum fructose-bisphosphate aldolase 0.0353 0.7292 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Onchocerca volvulus Notchless protein homolog 0.0034 0.018 0.0583
Brugia malayi plexin A 0.013 0.2334 0.2277
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0445 0.0374
Schistosoma mansoni netrin receptor unc5 0.0048 0.0495 0.1328
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0397 0.8268 1
Entamoeba histolytica proteasome subunit alpha type 2-A, putative 0.0034 0.018 0.0247
Plasmodium vivax proteasome subunit beta type-2, putative 0.0082 0.1266 0.3546
Brugia malayi RNA recognition motif domain containing protein 0.0071 0.1002 0.0934
Loa Loa (eye worm) hypothetical protein 0.0064 0.0859 0.2477
Trypanosoma cruzi proteasome subunit beta type-2, putative 0.0082 0.1266 0.3546
Schistosoma mansoni proteasome catalytic subunit 2 (T01 family) 0.0034 0.018 0.0333
Echinococcus multilocularis semaphorin 5B 0.0046 0.0456 0.0466
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0082 0.1266 0.3761
Loa Loa (eye worm) proteasome subunit beta type 1 0.0133 0.2393 0.7316
Giardia lamblia Proteasome subunit beta type 1 0.0133 0.2393 0.3112
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0034 0.018 0.0333
Echinococcus multilocularis proteasome subunit beta type 6 0.0034 0.018 0.0129
Brugia malayi Proteasome A-type and B-type family protein 0.0034 0.018 0.0106
Schistosoma mansoni proteasome subunit alpha 1 (T01 family) 0.0034 0.018 0.0333
Schistosoma mansoni ankyrin 23/unc44 0.0048 0.0495 0.1328
Echinococcus multilocularis proteasome subunit beta type 7 0.0034 0.018 0.0129
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0034 0.018 0.0129
Brugia malayi Uncoordinated protein 44 0.0048 0.0495 0.0424
Leishmania major proteasome beta 5 subunit, putative 0.0171 0.3244 1
Entamoeba histolytica proteasome subunit beta type 1, putative 0.0133 0.2393 0.3282
Loa Loa (eye worm) RNA binding protein 0.0071 0.1002 0.2926
Brugia malayi 20S proteasome alpha5 subunit 0.0034 0.018 0.0106
Schistosoma mansoni tar DNA-binding protein 0.0071 0.1002 0.2926
Mycobacterium leprae proteasome (beta subunit) PrcB 0.0171 0.3244 0.9911
Loa Loa (eye worm) hypothetical protein 0.0046 0.0456 0.1205
Loa Loa (eye worm) plexin A 0.013 0.2334 0.7131
Loa Loa (eye worm) sema domain-containing protein 0.0046 0.0456 0.1205
Schistosoma mansoni proteasome subunit beta 3 (T01 family) 0.0034 0.018 0.0333
Echinococcus multilocularis tar DNA binding protein 0.0071 0.1002 0.1132
Echinococcus granulosus nuclear factor of activated T cells 5 0.0397 0.8268 1
Plasmodium falciparum proteasome subunit beta type-2, putative 0.0082 0.1266 0.3546
Brugia malayi proteasome subunit beta type 2 0.0082 0.1266 0.1201
Mycobacterium tuberculosis Proteasome beta subunit PrcB; assembles with alpha subunit PrcA. 0.0171 0.3244 0.9911
Schistosoma mansoni proteasome subunit alpha 2 (T01 family) 0.0034 0.018 0.0333
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0082 0.1266 0.1455
Echinococcus multilocularis Proteasome subunit alpha type 7 0.0034 0.018 0.0129
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0133 0.2393 0.283
Entamoeba histolytica proteasome subunit alpha type 5, putative 0.0034 0.018 0.0247
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0133 0.2393 0.3112
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Echinococcus granulosus proteasome subunit beta type 6 0.0034 0.018 0.0129
Entamoeba histolytica proteasome subunit beta type 7-B precursor, putative 0.0034 0.018 0.0247
Echinococcus multilocularis proteasome (prosome macropain) subunit alpha 0.0034 0.018 0.0129
Loa Loa (eye worm) hypothetical protein 0.0048 0.0495 0.1328
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0445 0.0453
Brugia malayi proteasome subunit alpha type 4 0.0034 0.018 0.0106
Loa Loa (eye worm) proteasome subunit alpha type 7-1 0.0034 0.018 0.0333
Echinococcus granulosus proteasome prosome macropain subunit alpha 0.0034 0.018 0.0129
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0171 0.3244 0.4308
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Entamoeba histolytica proteasome subunit beta type 5 precursor, putative 0.0171 0.3244 0.4448
Entamoeba histolytica proteasome subunit alpha type 3, putative 0.0034 0.018 0.0247
Brugia malayi Immunoglobulin I-set domain containing protein 0.0048 0.0495 0.0424
Schistosoma mansoni subfamily T1A non-peptidase homologue (T01 family) 0.0034 0.018 0.0333
Giardia lamblia Proteasome subunit beta type 2 0.0082 0.1266 0.1527
Brugia malayi proteasome subunit alpha type 2 0.0034 0.018 0.0106
Echinococcus granulosus plexin a4 0.013 0.2334 0.2758
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.7292 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0501 0.1346
Loa Loa (eye worm) proteasome subunit alpha type 1 0.0034 0.018 0.0333
Loa Loa (eye worm) proteasome subunit alpha type 3 0.0034 0.018 0.0333
Loa Loa (eye worm) proteasome subunit alpha type 2 0.0034 0.018 0.0333
Brugia malayi TAR-binding protein 0.0071 0.1002 0.0934
Echinococcus granulosus proteasome subunit alpha type 6 0.0034 0.018 0.0129
Brugia malayi hypothetical protein 0.0046 0.0456 0.0385
Echinococcus multilocularis netrin receptor unc 5 0.0048 0.0495 0.0514
Echinococcus granulosus proteasome prosome macropain 0.0171 0.3244 0.3868
Schistosoma mansoni hypothetical protein 0.0046 0.0456 0.1205
Loa Loa (eye worm) proteasome subunit beta type 3 0.0034 0.018 0.0333
Onchocerca volvulus 0.0046 0.0456 0.2109

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

Bibliographic References

No literature references available for this target.

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