Detailed information for compound 1623168

Basic information

Technical information
  • TDR Targets ID: 1623168
  • Name: 8-hydroxyocta-2,4,6-triynamide
  • MW: 147.131 | Formula: C8H5NO2
  • H donors: 2 H acceptors: 2 LogP: -0.33 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCC#CC#CC#CC(=O)N
  • InChi: 1S/C8H5NO2/c9-8(11)6-4-2-1-3-5-7-10/h10H,7H2,(H2,9,11)
  • InChiKey: OXONWCQUZYDTNF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 544-44-5
  • NCI60_012071
  • AIDS-135766
  • AIDS135766
  • NSC636326
  • 2,4,6-OCTATRIYNAMIDE, 8-HYDROXY-
  • 4-03-00-01047 (Beilstein Handbook Reference)
  • 8-Hydroxy-2,4,6-octatriynamide
  • Agrocybin
  • BRN 1761957

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
Giardia lamblia Phosphatidylinositol 4-kinase 0.0199 0.0318 0.0135
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Echinococcus multilocularis 0.0199 0.0318 0.0318
Trichomonas vaginalis PIKK family atypical protein kinase 0.1755 0.5824 0.5745
Trichomonas vaginalis PIKK family atypical protein kinase 0.1601 0.528 0.5191
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.0199 0.0318 0.661
Trichomonas vaginalis PIKK family atypical protein kinase 0.2935 1 1
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0218 0.0386 0.0352
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis PIKK family atypical protein kinase 0.0573 0.1641 0.1483
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0218 0.0386 0.0096
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.106 0.3366 0.3241
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0218 0.0386 0.0204
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0218 0.0386 0.0386
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0199 0.0318 0.0318
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0374 0.0936 0.0765
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0168 0.0208 0.0208
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0438 0.1165 0.1165
Onchocerca volvulus 0.0199 0.0318 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0199 0.0318 0.0318
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0384 0.0973 0.0803
Entamoeba histolytica protein kinase rad3, putative 0.0573 0.1641 0.1483
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.2935 1 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.2345 0.7913 0.7873
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0638 0.187 0.2199
Schistosoma mansoni immunophilin 0.0139 0.0107 0.0071
Trichomonas vaginalis conserved hypothetical protein 0.0374 0.0936 0.0765
Leishmania major hypothetical protein, unknown function 0.0199 0.0318 0.0135
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0199 0.0318 0.0284
Trichomonas vaginalis PIKK family atypical protein kinase 0.0583 0.1678 0.152
Loa Loa (eye worm) hypothetical protein 0.0638 0.187 0.187
Schistosoma mansoni immunophilin 0.0162 0.0186 0.0151
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.2935 1 1
Giardia lamblia Hypothetical protein 0.0199 0.0318 0.0135
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0552 0.1568 0.1538
Trichomonas vaginalis PIKK family atypical protein kinase 0.2935 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.2935 1 1
Leishmania major phosphatidylinositol kinase related protein, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0257 0.0524 0.0345
Loa Loa (eye worm) hypothetical protein 0.0199 0.0318 0.0318
Loa Loa (eye worm) hypothetical protein 0.0317 0.0735 0.0735
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0199 0.0318 0.0318
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.0199 0.0318 0.661
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.661
Trichomonas vaginalis PIKK family atypical protein kinase 0.1969 0.6582 0.6517
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Toxoplasma gondii FATC domain-containing protein 0.0573 0.1641 0.1874
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0162 0.0186 0.5
Loa Loa (eye worm) hypothetical protein 0.0139 0.0107 0.0107
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0552 0.1568 0.1568
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.2345 0.7913 0.7873
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0199 0.0318 0.0318
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0317 0.0735 0.0735
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0162 0.0186 0.0186
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0162 0.0186 0.0186
Plasmodium vivax hypothetical protein 0.0199 0.0318 0.661
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0286 0.0624 0.0447
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0162 0.0186 0.0186
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0384 0.0973 0.0973
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0573 0.1641 0.1641
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0384 0.0973 0.0803
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0218 0.0386 0.0352
Echinococcus multilocularis Zinc finger, PHD finger 0.0218 0.0386 0.0386
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0162 0.0186 0.0151
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Trichomonas vaginalis PIKK family atypical protein kinase 0.0573 0.1641 0.1483
Entamoeba histolytica hypothetical protein 0.0199 0.0318 0.0135
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0573 0.1641 0.1483
Entamoeba histolytica hypothetical protein 0.0199 0.0318 0.0135
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0573 0.1641 0.1641
Loa Loa (eye worm) phosphatidylinositol 3 0.1022 0.323 0.323
Schistosoma mansoni hypothetical protein 0.0199 0.0318 0.0284
Trichomonas vaginalis PIKK family atypical protein kinase 0.1011 0.3193 0.3064
Schistosoma mansoni hypothetical protein 0.0438 0.1165 0.1134
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0199 0.0318 0.0284
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0162 0.0186 0.0186
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis PIKK family atypical protein kinase 0.2343 0.7904 0.7865
Trichomonas vaginalis PIKK family atypical protein kinase 0.1603 0.5288 0.5199
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.2935 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1601 0.528 0.5191
Loa Loa (eye worm) phosphatidylinositol 3 0.0199 0.0318 0.0318
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0199 0.0318 0.0318
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.0583 0.1678 0.152
Trichomonas vaginalis PIKK family atypical protein kinase 0.1011 0.3193 0.3064
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0449 0.1201 0.1201
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0218 0.0386 0.0204
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.123 0.3966 0.3852
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0325 0.0762 0.0587
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.2935 1 1
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0218 0.0386 1
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0257 0.0524 0.0345
Loa Loa (eye worm) phosphatidylinositol kinase 0.0199 0.0318 0.0318
Trichomonas vaginalis PIKK family atypical protein kinase 0.1011 0.3193 0.3064
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.2935 1 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0199 0.0318 0.5
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0218 0.0386 0.0204
Trichomonas vaginalis conserved hypothetical protein 0.0438 0.1165 0.0998
Leishmania major phosphatidylinositol kinase, putative 0.0199 0.0318 0.0135
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0139 0.0107 0.0107
Trichomonas vaginalis PIKK family atypical protein kinase 0.0789 0.2405 0.2262
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0218 0.0386 0.0386
Trichomonas vaginalis PIKK family atypical protein kinase 0.1753 0.5817 0.5738
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0199 0.0318 0.0135
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0162 0.0186 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.1011 0.3193 0.3064
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0325 0.0762 0.0587
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0199 0.0318 0.0135
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0218 0.0386 0.0204
Echinococcus multilocularis fk506 binding protein 0.0162 0.0186 0.0186
Trichomonas vaginalis PIKK family atypical protein kinase 0.1904 0.6352 0.6283
Loa Loa (eye worm) hypothetical protein 0.059 0.17 0.17
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0384 0.0973 0.0803
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0438 0.1165 0.1165
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.2935 1 1
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0573 0.1641 0.1611
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.1022 0.323 0.3102
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0257 0.0524 0.0345
Loa Loa (eye worm) phosphatidylinositol 3 0.2935 1 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0238 0.0456 0.0276
Trichomonas vaginalis PIKK family atypical protein kinase 0.2496 0.8448 0.8419
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0199 0.0318 0.0318
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0218 0.0386 0.0204
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0218 0.0386 0.0204
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.2935 1 1
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0218 0.0386 0.0386
Leishmania major phosphatidylinositol 3-related kinase, putative 0.1022 0.323 0.3102
Leishmania major phosphatidylinositol 3-kinase, putative 0.0218 0.0386 0.0204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0374 0.0936 0.0765
Leishmania major phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.0135
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0317 0.0735 0.0735
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0218 0.0386 0.0204
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.1381 0.4501 0.4397
Trichomonas vaginalis PIKK family atypical protein kinase 0.2343 0.7904 0.7865
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.0199 0.0318 0.0135
Toxoplasma gondii target of rapamycin (TOR), putative 0.2193 0.7376 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1603 0.5288 0.5199
Loa Loa (eye worm) hypothetical protein 0.0438 0.1165 0.1165
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0218 0.0386 1
Mycobacterium leprae conserved hypothetical protein 0.0199 0.0318 0.5
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0257 0.0524 0.0345
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.2935 1 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0199 0.0318 0.0318
Entamoeba histolytica hypothetical protein 0.0573 0.1641 0.1483
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0199 0.0318 0.0318
Schistosoma mansoni fkbp-rapamycin associated protein 0.0573 0.1641 0.1611
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0552 0.1568 0.1568
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0257 0.0524 0.049
Trichomonas vaginalis PIKK family atypical protein kinase 0.2343 0.7904 0.7865
Trichomonas vaginalis PIKK family atypical protein kinase 0.1603 0.5288 0.5199
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0218 0.0386 0.0204
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.661
Trichomonas vaginalis PIKK family atypical protein kinase 0.1022 0.323 0.3102
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0573 0.1641 0.1483
Entamoeba histolytica hypothetical protein 0.0199 0.0318 0.0135
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0257 0.0524 0.0345
Echinococcus granulosus serine protein kinase ATM 0.0573 0.1641 0.1641
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0384 0.0973 0.0803
Trichomonas vaginalis PIKK family atypical protein kinase 0.2343 0.7904 0.7865
Trichomonas vaginalis PIKK family atypical protein kinase 0.0199 0.0318 0.0135
Trichomonas vaginalis PIKK family atypical protein kinase 0.0199 0.0318 0.0135
Loa Loa (eye worm) hypothetical protein 0.0573 0.1641 0.1641
Onchocerca volvulus 0.0199 0.0318 0.5
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0199 0.0318 0.661
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0218 0.0386 0.0096
Trichomonas vaginalis PIKK family atypical protein kinase 0.2193 0.7376 0.7326
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0139 0.0107 0.0107
Plasmodium vivax hypothetical protein, conserved 0.0199 0.0318 0.661
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0345 0.0835 0.0662
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.2935 1 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0573 0.1641 0.1641
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0199 0.0318 0.0318
Trichomonas vaginalis PIKK family atypical protein kinase 0.1603 0.5288 0.5199
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0384 0.0973 0.0803
Trichomonas vaginalis PIKK family atypical protein kinase 0.1601 0.528 0.5191
Loa Loa (eye worm) FKBP5 protein 0.0162 0.0186 0.0186
Entamoeba histolytica hypothetical protein 0.0345 0.0835 0.0662
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0384 0.0973 0.0803
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0257 0.0524 0.0345
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0162 0.0186 0.0186
Loa Loa (eye worm) phosphatidylinositol 3 0.0199 0.0318 0.0318
Trichomonas vaginalis PIKK family atypical protein kinase 0.1753 0.5817 0.5738
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.0199 0.0318 0.0135
Loa Loa (eye worm) hypothetical protein 0.0374 0.0936 0.0936
Trypanosoma cruzi target of rapamycin kinase 3 0.2345 0.7913 0.7873
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0218 0.0386 0.0386
Loa Loa (eye worm) phosphatidylinositol 3 0.0513 0.143 0.143
Trichomonas vaginalis PIKK family atypical protein kinase 0.1755 0.5824 0.5745
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0218 0.0386 0.0386
Brugia malayi FAT domain containing protein 0.0438 0.1165 0.1165
Trichomonas vaginalis conserved hypothetical protein 0.0638 0.187 0.1716
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0185 0.0269 0.0085
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.2935 1 1
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0317 0.0735 0.0735
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0278 0.0598 0.042
Schistosoma mansoni immunophilin 0.0162 0.0186 0.0151
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.0135
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0257 0.0524 0.0345
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0573 0.1641 0.1483
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0257 0.0524 0.0524
Giardia lamblia GTOR 0.2935 1 1
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0162 0.0186 0.0186
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.106 0.3366 0.3366
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.1011 0.3193 0.3064
Trichomonas vaginalis PIKK family atypical protein kinase 0.1755 0.5824 0.5745
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.106 0.3366 0.3366
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0199 0.0318 0.0284
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.106 0.3366 0.3366
Echinococcus multilocularis serine protein kinase ATM 0.0573 0.1641 0.1641
Trichomonas vaginalis PIKK family atypical protein kinase 0.2935 1 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.1011 0.3193 0.3064
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0199 0.0318 0.0135
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0573 0.1641 0.1641
Trichomonas vaginalis PIKK family atypical protein kinase 0.2343 0.7904 0.7865
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0449 0.1201 0.1201
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.106 0.3366 0.3342
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0218 0.0386 0.0204
Loa Loa (eye worm) phosphatidylinositol 3 0.0199 0.0318 0.0318
Leishmania major hypothetical protein, conserved 0.0288 0.0631 0.0454
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.106 0.3366 0.3241

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5.898 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.874 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.711 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.708 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.708 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.704 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.674 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.643 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (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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