Detailed information for compound 1467772

Basic information

Technical information
  • TDR Targets ID: 1467772
  • Name: BAS 12433720
  • MW: 184.237 | Formula: C12H12N2
  • H donors: 1 H acceptors: 1 LogP: 1.41 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: NC(c1cccnc1)c1ccccc1
  • InChi: 1S/C12H12N2/c13-12(10-5-2-1-3-6-10)11-7-4-8-14-9-11/h1-9,12H,13H2
  • InChiKey: XDYKWHGBZMOSDC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ZERO/008827

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
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0688 0.038 0.4316
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0308 0.015 0.0563
Leishmania major phosphatidylinositol kinase, putative 0.025 0.0116 0.0319
Loa Loa (eye worm) phosphatidylinositol 3 0.1265 0.0727 1
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.088 0.0495 0.0384
Loa Loa (eye worm) phosphatidylinositol kinase 0.025 0.0116 0.159
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9773
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.025 0.0116 0.156
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0488 0.0259 0.0145
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0702 0.0388 0.1118
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0308 0.015 0.0551
Trichomonas vaginalis PIKK family atypical protein kinase 0.0735 0.0408 0.4778
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.088 0.0495 0.6075
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.025 0.0116 0.0333
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0322 0.0159 0.0703
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0308 0.015 0.0563
Leishmania major hypothetical protein, conserved 0.6061 0.362 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0809 0.0452 0.6222
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0128 0.0042 0.0121
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.1231 0.0707 0.9724
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0718 0.0398 0.5468
Echinococcus multilocularis serine protein kinase ATM 0.0718 0.0398 0.0285
Leishmania major phosphatidylinositol 4-kinase, putative 0.025 0.0116 0.0319
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.1243 0.0714 0.9823
Loa Loa (eye worm) phosphatidylinositol 3 0.025 0.0116 0.159
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.1287 0.0741 0.0633
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.1265 0.0727 0.0619
Trichomonas vaginalis PIKK family atypical protein kinase 0.1244 0.0715 0.9798
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0059 0 0.5
Brugia malayi Cytochrome P450 family protein 0.0124 0.0039 0.0532
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0688 0.038 0.4316
Entamoeba histolytica hypothetical protein 0.0718 0.0398 0.4611
Trichomonas vaginalis conserved hypothetical protein 0.053 0.0284 0.2752
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0417 0.0216 0.1641
Trichomonas vaginalis conserved hypothetical protein 0.0451 0.0237 0.198
Trichomonas vaginalis PIKK family atypical protein kinase 0.0702 0.0388 0.445
Trichomonas vaginalis PIKK family atypical protein kinase 0.1254 0.0721 0.9899
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0308 0.015 0.0035
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0308 0.015 0.2063
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0579 0.0314 0.3237
Trichomonas vaginalis PIKK family atypical protein kinase 0.1254 0.0721 0.9899
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.1265 0.0727 0.0619
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0702 0.0388 0.5234
Trichomonas vaginalis PIKK family atypical protein kinase 0.0714 0.0395 0.4568
Trypanosoma brucei target of rapamycin kinase 3, putative 0.1254 0.0721 0.9915
Trichomonas vaginalis PIKK family atypical protein kinase 0.1254 0.0721 0.9899
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0702 0.0388 0.0275
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.1287 0.0741 0.2136
Loa Loa (eye worm) hypothetical protein 0.078 0.0435 0.5981
Trichomonas vaginalis PIKK family atypical protein kinase 0.0725 0.0402 0.4677
Loa Loa (eye worm) phosphatidylinositol 3 0.0128 0.0042 0.0578
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.025 0.0116 0.156
Brugia malayi FAT domain containing protein 0.053 0.0284 0.3832
Trichomonas vaginalis PIKK family atypical protein kinase 0.0451 0.0237 0.198
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0379 0.0193 0.1266
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0267 0.0125 0.0362
Loa Loa (eye worm) phosphatidylinositol 3 0.025 0.0116 0.159
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.1265 0.0727 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1265 0.0727 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0722 0.04 0.4652
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.053 0.0284 0.017
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.025 0.0116 0.0333
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0688 0.038 0.4316
Schistosoma mansoni hypothetical protein 0.053 0.0284 0.2692
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.079 0.0441 0.6066
Giardia lamblia GTOR 0.1265 0.0727 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.1265 0.0727 0.2096
Trichomonas vaginalis PIKK family atypical protein kinase 0.1243 0.0714 0.979
Toxoplasma gondii target of rapamycin (TOR), putative 0.1252 0.0719 1
Trypanosoma cruzi target of rapamycin kinase 3 0.1254 0.0721 0.2079
Onchocerca volvulus 0.025 0.0116 0.5
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.1254 0.0721 0.1992
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0192 0.008 0.1086
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0308 0.015 0.057
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0308 0.015 1
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0308 0.015 0.2063
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9773
Schistosoma mansoni fkbp-rapamycin associated protein 0.0702 0.0388 0.4352
Leishmania major hypothetical protein, unknown function 0.025 0.0116 0.0319
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.1265 0.0727 0.2096
Loa Loa (eye worm) hypothetical protein 0.025 0.0116 0.159
Echinococcus multilocularis Zinc finger, PHD finger 0.0308 0.015 0.0035
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.1265 0.0727 1
Echinococcus granulosus serine protein kinase ATM 0.0718 0.0398 0.0285
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.1265 0.0727 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0261 0.0122 0.0101
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.088 0.0495 0.0384
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1287 0.0741 1
Toxoplasma gondii FATC domain-containing protein 0.0718 0.0398 0.467
Loa Loa (eye worm) cytochrome P450 family protein 0.0124 0.0039 0.0542
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9773
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.025 0.0116 0.156
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9772
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0438 0.0228 0.1846
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0308 0.015 0.057
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9772
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0688 0.038 0.5123
Onchocerca volvulus 0.025 0.0116 0.5
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0379 0.0193 0.2655
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0468 0.0247 0.0711
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 1.6642 1 1
Trichomonas vaginalis conserved hypothetical protein 0.078 0.0435 0.5222
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9772
Trichomonas vaginalis PIKK family atypical protein kinase 0.1231 0.0707 0.9672
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Trichomonas vaginalis PIKK family atypical protein kinase 0.1242 0.0713 0.9773
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0379 0.0193 0.1266
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1265 0.0727 0.9815
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0718 0.0398 0.5366
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0379 0.0193 0.1239
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Loa Loa (eye worm) phosphatidylinositol 3 0.025 0.0116 0.159
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0379 0.0193 0.1266
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0617 0.0337 0.3612
Loa Loa (eye worm) hypothetical protein 0.0488 0.0259 0.3561
Leishmania major phosphatidylinositol 3-related kinase, putative 0.1243 0.0714 0.1973
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0271 0.0128 0.1759
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0688 0.038 0.1094
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Loa Loa (eye worm) hypothetical protein 0.0702 0.0388 0.5332
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0308 0.015 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1265 0.0727 1
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.053 0.0284 0.017
Loa Loa (eye worm) phosphatidylinositol 3 0.025 0.0116 0.159
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.025 0.0116 0.0333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0718 0.0398 0.4611
Loa Loa (eye worm) hypothetical protein 0.02 0.0085 0.117
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.1265 0.0727 0.2009
Loa Loa (eye worm) hypothetical protein 0.053 0.0284 0.3904
Entamoeba histolytica protein kinase rad3, putative 0.0702 0.0388 0.445
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0379 0.0193 0.0557
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0579 0.0314 0.3237
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.0714 0.0395 0.4568
Trichomonas vaginalis PIKK family atypical protein kinase 0.1265 0.0727 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1254 0.0721 0.9899
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0488 0.0259 0.0145
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0308 0.015 0.0433
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0718 0.0398 0.451
Trichomonas vaginalis PIKK family atypical protein kinase 0.0722 0.04 0.4652
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.025 0.0116 0.0333
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.025 0.0116 0.159
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.1287 0.0741 0.2136
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0379 0.0193 0.2605
Mycobacterium tuberculosis Conserved hypothetical protein 0.025 0.0116 0.5
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0308 0.015 0.0433
Trichomonas vaginalis PIKK family atypical protein kinase 0.1254 0.0721 0.9899
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0688 0.038 0.4316
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0718 0.0398 0.1146
Trichomonas vaginalis PIKK family atypical protein kinase 0.1231 0.0707 0.9672
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0379 0.0193 0.1266
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0702 0.0388 0.0275
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0308 0.015 0.0563
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.1265 0.0727 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1244 0.0715 0.9798
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0308 0.015 0.0035
Leishmania major phosphatidylinositol 3-kinase, putative 0.1231 0.0707 0.1953
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.1287 0.0741 0.0633
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0308 0.015 0.0035
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0308 0.015 0.2025
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0308 0.015 0.0551
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.1265 0.0727 0.9781
Leishmania major phosphatidylinositol kinase related protein, putative 0.0267 0.0125 0.0347
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.1265 0.0727 0.2009
Loa Loa (eye worm) phosphatidylinositol 3 0.1243 0.0714 0.9823
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0308 0.015 0.0414
Loa Loa (eye worm) hypothetical protein 0.0468 0.0247 0.339
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.025 0.0116 0.159
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0507 0.0271 0.2534
Trichomonas vaginalis PIKK family atypical protein kinase 0.1231 0.0707 0.9672
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0379 0.0193 0.1266
Trichomonas vaginalis PIKK family atypical protein kinase 0.0722 0.04 0.4652
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.1287 0.0741 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0308 0.015 0.0563
Trypanosoma cruzi hypothetical protein, conserved 0.5811 0.3469 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Leishmania major phosphatidylinositol 3-kinase, putative 0.0308 0.015 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.0803 0.0449 0.5449
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0688 0.038 0.1094
Toxoplasma gondii non-specific serine/threonine protein kinase 0.078 0.0435 0.5289
Entamoeba histolytica hypothetical protein 0.0617 0.0337 0.3612
Trichomonas vaginalis PIKK family atypical protein kinase 0.1252 0.0719 0.9873
Mycobacterium leprae conserved hypothetical protein 0.025 0.0116 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0308 0.015 0.0563
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0488 0.0259 0.3495
Trichomonas vaginalis PIKK family atypical protein kinase 0.1231 0.0707 0.9672

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.
 
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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