Detailed information for compound 1647129

Basic information

Technical information
  • TDR Targets ID: 1647129
  • Name: 2-(hydroxy-phenylmethyl)-1,3-dithiane-2-carbo xylic acid
  • MW: 270.368 | Formula: C12H14O3S2
  • H donors: 2 H acceptors: 3 LogP: 2.05 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(C1(SCCCS1)C(=O)O)c1ccccc1
  • InChi: 1S/C12H14O3S2/c13-10(9-5-2-1-3-6-9)12(11(14)15)16-7-4-8-17-12/h1-3,5-6,10,13H,4,7-8H2,(H,14,15)
  • InChiKey: NFKSFBPBJJZFPH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(hydroxy-phenyl-methyl)-1,3-dithiane-2-carboxylic acid
  • NCI60_021691
  • 2-(Hydroxy(phenyl)methyl)-1,3-dithiane-2-carboxylic acid
  • AIDS-143116
  • AIDS143116
  • NSC662786

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 PIKK family atypical protein kinase 0.1264 0.1795 0.1795
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.0484
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.064 0.0819 0.081
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0432 0.0494 0.9348
Trichomonas vaginalis conserved hypothetical protein 0.0964 0.1325 0.1325
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.0484
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.6517 1 1
Toxoplasma gondii non-specific serine/threonine protein kinase 0.1395 0.1999 0.2176
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0122 0.001 0.5
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.6517 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.6517 1 1
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0564 0.0701 0.0692
Onchocerca volvulus 0.0432 0.0494 0.5
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0497 0.0596 0.0587
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.9348
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0432 0.0494 0.0484
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Trichomonas vaginalis immunophilin, putative 0.0122 0.001 0.001
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.1253 0.1776 0.1768
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Trichomonas vaginalis PIKK family atypical protein kinase 0.4372 0.6649 0.6649
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0432 0.0494 0.0484
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.0484
Schistosoma mansoni hypothetical protein 0.0964 0.1325 0.1316
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.5198 0.794 0.7938
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0432 0.0494 0.0484
Entamoeba histolytica hypothetical protein 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.3535 0.5341 0.5341
Trichomonas vaginalis PIKK family atypical protein kinase 0.3895 0.5905 0.5905
Toxoplasma gondii target of rapamycin (TOR), putative 0.4859 0.741 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0432 0.0494 0.0484
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.2271 0.3368 0.3361
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0453 0.0528 0.0518
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.1253 0.1776 0.1768
Trichomonas vaginalis PIKK family atypical protein kinase 0.0432 0.0494 0.0494
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Trichomonas vaginalis PIKK family atypical protein kinase 0.6517 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0432 0.0494 0.0494
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0453 0.0528 0.0518
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0432 0.0494 0.0484
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0453 0.0528 0.0049
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0453 0.0528 0.0518
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0189 0.0115 0.0105
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.064 0.0819 0.081
Giardia lamblia Phosphatidylinositol 4-kinase 0.0432 0.0494 0.0484
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.064 0.0819 0.0819
Entamoeba histolytica hypothetical protein 0.1253 0.1776 0.1768
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0829 0.1115 0.1106
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.9348
Loa Loa (eye worm) hypothetical protein 0.1395 0.1999 0.1991
Trypanosoma brucei target of rapamycin kinase 3, putative 0.5198 0.794 0.7938
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.6517 1 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0453 0.0528 0.0528
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0964 0.1325 0.1316
Trichomonas vaginalis PIKK family atypical protein kinase 0.2216 0.3281 0.3281
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.1264 0.1795 0.1787
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.2719 0.4067 0.4061
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0432 0.0494 0.0484
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0573 0.0714 0.0714
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0453 0.0528 1
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.6517 1 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0432 0.0494 0.0484
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0497 0.0596 0.0587
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0453 0.0528 0.0518
Loa Loa (eye worm) hypothetical protein 0.0432 0.0494 0.0484
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.6517 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2216 0.3281 0.3281
Loa Loa (eye worm) hypothetical protein 0.0821 0.1102 0.1094
Mycobacterium leprae conserved hypothetical protein 0.0432 0.0494 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.064 0.0819 0.0819
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0124 0.0013 0.0003
Entamoeba histolytica hypothetical protein 0.0432 0.0494 0.0484
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0529 0.0646 0.0636
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0122 0.001 0.001
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0564 0.0701 0.0692
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.1253 0.1776 0.1768
Echinococcus multilocularis Zinc finger, PHD finger 0.0453 0.0528 0.0518
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0712 0.0932 0.0923
Schistosoma mansoni fkbp-rapamycin associated protein 0.1253 0.1776 0.1768
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0122 0.001 0.5
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0453 0.0528 0.0518
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.2228 0.33 0.3293
Loa Loa (eye worm) hypothetical protein 0.1253 0.1776 0.1768
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0432 0.0494 0.0484
Entamoeba histolytica hypothetical protein 0.0432 0.0494 0.0484
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.1253 0.1776 0.1768
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.2216 0.3281 0.3275
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.0432 0.0494 0.0484
Leishmania major phosphatidylinositol kinase related protein, putative 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.5193 0.7932 0.7932
Trichomonas vaginalis PIKK family atypical protein kinase 0.354 0.535 0.535
Trichomonas vaginalis fk506-binding protein, putative 0.0122 0.001 0.001
Leishmania major hypothetical protein, unknown function 0.0432 0.0494 0.0484
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0821 0.1102 0.1094
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.3535 0.5341 0.5341
Leishmania major phosphatidylinositol kinase, putative 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.6517 1 1
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0453 0.0528 0.0518
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0453 0.0528 1
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.5554 0.8495 0.8495
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0453 0.0528 0.0528
Trichomonas vaginalis PIKK family atypical protein kinase 0.2228 0.33 0.33
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0453 0.0528 0.0518
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.6517 1 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0564 0.0701 0.0692
Loa Loa (eye worm) phosphatidylinositol kinase 0.0432 0.0494 0.0484
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.064 0.0819 0.0819
Loa Loa (eye worm) phosphatidylinositol 3 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.5193 0.7932 0.7932
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0453 0.0528 0.0518
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.3074 0.4622 0.4617
Loa Loa (eye worm) phosphatidylinositol 3 0.0432 0.0494 0.0484
Loa Loa (eye worm) phosphatidylinositol 3 0.6517 1 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0497 0.0596 0.0596
Leishmania major phosphatidylinositol 3-kinase, putative 0.0453 0.0528 0.0518
Trichomonas vaginalis PIKK family atypical protein kinase 0.354 0.535 0.535
Trichomonas vaginalis conserved hypothetical protein 0.0821 0.1102 0.1102
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Trichomonas vaginalis PIKK family atypical protein kinase 0.1253 0.1776 0.1776
Loa Loa (eye worm) phosphatidylinositol 3 0.0432 0.0494 0.0484
Echinococcus granulosus serine protein kinase ATM 0.1253 0.1776 0.1768
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.0432 0.0494 0.9348
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.0432 0.0494 0.9348
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0964 0.1325 0.1316
Trichomonas vaginalis PIKK family atypical protein kinase 0.354 0.535 0.535
Trichomonas vaginalis PIKK family atypical protein kinase 0.5193 0.7932 0.7932
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0497 0.0596 0.0587
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0453 0.0528 0.0518
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.0432 0.0494 0.0484
Echinococcus multilocularis serine protein kinase ATM 0.1253 0.1776 0.1768
Loa Loa (eye worm) phosphatidylinositol 3 0.2228 0.33 0.3293
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0432 0.0494 0.0494
Trichomonas vaginalis PIKK family atypical protein kinase 0.3874 0.5872 0.5872
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0453 0.0528 0.0518
Trichomonas vaginalis PIKK family atypical protein kinase 0.175 0.2554 0.2554
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0573 0.0714 0.0714
Leishmania major phosphatidylinositol 3-kinase, putative 0.2216 0.3281 0.3275
Schistosoma mansoni voltage-gated potassium channel 0.0135 0.003 0.002
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0829 0.1115 0.1106
Loa Loa (eye worm) hypothetical protein 0.1319 0.188 0.1872
Loa Loa (eye worm) phosphatidylinositol 3 0.0785 0.1046 0.1037
Trichomonas vaginalis PIKK family atypical protein kinase 0.423 0.6427 0.6427
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0124 0.0013 0.0003
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0432 0.0494 0.0494
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0453 0.0528 0.0049
Entamoeba histolytica protein kinase rad3, putative 0.1253 0.1776 0.1768
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.6517 1 1
Leishmania major phosphatidylinositol 3-related kinase, putative 0.2228 0.33 0.3293
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0497 0.0596 0.0587
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0475 0.0562 0.0553
Giardia lamblia GTOR 0.6517 1 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.6517 1 1
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0208 0.0145 0.0135
Trichomonas vaginalis conserved hypothetical protein 0.1395 0.1999 0.1999
Echinococcus multilocularis 0.0432 0.0494 0.0484
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.052 0.0633 0.0623
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0124 0.0013 0.0003
Loa Loa (eye worm) hypothetical protein 0.0564 0.0701 0.0692
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0497 0.0596 0.0596
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.6517 1 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1253 0.1776 0.1768
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0497 0.0596 0.0596
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.2271 0.3368 0.3361
Trichomonas vaginalis PIKK family atypical protein kinase 0.3895 0.5905 0.5905
Trichomonas vaginalis PIKK family atypical protein kinase 0.2216 0.3281 0.3281
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.2271 0.3368 0.3361
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0124 0.0013 0.0003
Toxoplasma gondii FATC domain-containing protein 0.1253 0.1776 0.1855
Leishmania major phosphatidylinositol 4-kinase, putative 0.0432 0.0494 0.0484
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.2271 0.3368 0.3361
Echinococcus granulosus serine:threonine protein kinase SMG1 0.1253 0.1776 0.1768
Trichomonas vaginalis PIKK family atypical protein kinase 0.5193 0.7932 0.7932
Mycobacterium tuberculosis Conserved hypothetical protein 0.0432 0.0494 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.2216 0.3281 0.3281
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.6517 1 1
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.2271 0.3368 0.3361
Brugia malayi FAT domain containing protein 0.0964 0.1325 0.1316
Leishmania major hypothetical protein, conserved 0.0531 0.0649 0.064
Plasmodium vivax hypothetical protein 0.0432 0.0494 0.9348
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.2271 0.3368 0.3361
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0453 0.0528 0.0518
Onchocerca volvulus 0.0432 0.0494 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.5193 0.7932 0.7932
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.064 0.0819 0.081
Trichomonas vaginalis PIKK family atypical protein kinase 0.1253 0.1776 0.1776
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0497 0.0596 0.0587
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0432 0.0494 0.0484
Schistosoma mansoni hypothetical protein 0.0432 0.0494 0.0484
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1253 0.1776 0.1768
Trichomonas vaginalis PIKK family atypical protein kinase 0.6517 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.4859 0.741 0.741
Entamoeba histolytica hypothetical protein 0.0596 0.0751 0.0742
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0432 0.0494 0.0484
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0453 0.0528 0.0518
Giardia lamblia Hypothetical protein 0.0432 0.0494 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.354 0.535 0.535
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0712 0.0932 0.0923
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.1253 0.1776 0.1768
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0596 0.0751 0.0742
Trichomonas vaginalis PIKK family atypical protein kinase 0.0821 0.1102 0.1102
Schistosoma mansoni voltage-gated potassium channel 0.0135 0.003 0.002
Trichomonas vaginalis PIKK family atypical protein kinase 0.3535 0.5341 0.5341
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0432 0.0494 0.0484
Plasmodium vivax hypothetical protein, conserved 0.0432 0.0494 0.9348
Trichomonas vaginalis PIKK family atypical protein kinase 0.3874 0.5872 0.5872
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0122 0.001 0.001
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0497 0.0596 0.0587
Trypanosoma cruzi target of rapamycin kinase 3 0.5198 0.794 0.7938
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.064 0.0819 0.081
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0453 0.0528 0.0518
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0829 0.1115 0.1106
Trichomonas vaginalis PIKK family atypical protein kinase 0.3895 0.5905 0.5905
Loa Loa (eye worm) hypothetical protein 0.0964 0.1325 0.1316
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0453 0.0528 0.0528

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 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 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 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 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 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 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
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System 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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