Detailed information for compound 1611389

Basic information

Technical information
  • TDR Targets ID: 1611389
  • Name: N-(naphthalen-2-ylmethylideneamino)-4,5,6,7-t etrahydro-1H-1,3-diazepin-2-amine hydroiodide
  • MW: 394.253 | Formula: C16H19IN4
  • H donors: 2 H acceptors: 0 LogP: 3.88 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: C1CCNC(=N/N=C/c2ccc3c(c2)cccc3)NC1.I
  • InChi: 1S/C16H18N4.HI/c1-2-6-15-11-13(7-8-14(15)5-1)12-19-20-16-17-9-3-4-10-18-16;/h1-2,5-8,11-12H,3-4,9-10H2,(H2,17,18,20);1H/b19-12+;
  • InChiKey: KPUKCGZHBRAMBY-NNTHFVATSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-naphthylmethyleneamino)-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine hydroiodide
  • (2-naphthylmethyleneamino)-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)amine hydroiodide
  • NSC676148

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 phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0498 0.0733 0.0733
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.2238 0.405 0.4045
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.1828 0.3268 0.3268
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.1046 0.1776 0.1769
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0379 0.0505 0.0505
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0794 0.1297 0.129
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0423 0.0589 0.0581
Loa Loa (eye worm) phosphatidylinositol 3 0.0357 0.0463 0.0455
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.5359 1 1
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0379 0.0505 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0712 0.114 0.1132
Trichomonas vaginalis PIKK family atypical protein kinase 0.1828 0.3268 0.3268
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.5359 1 1
Loa Loa (eye worm) hypothetical protein 0.0357 0.0463 0.0455
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0379 0.0505 0.0497
Mycobacterium leprae conserved hypothetical protein 0.0357 0.0463 0.5
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.1034 0.1754 0.1747
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.049 0.0717 0.0709
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0118 0.0009 0.0009
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0454 0.0649 0.0641
Entamoeba histolytica hypothetical protein 0.0357 0.0463 0.0455
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0122 0.0015 0.0007
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0566 0.0862 0.0862
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0379 0.0505 0.0497
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0118 0.0009 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Schistosoma mansoni fkbp-rapamycin associated protein 0.1034 0.1754 0.1747
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0639 0.1001 0.0993
Echinococcus multilocularis Zinc finger, PHD finger 0.0379 0.0505 0.0497
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.0357 0.0463 0.0455
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.1828 0.3268 0.3262
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.1034 0.1754 0.1747
Entamoeba histolytica hypothetical protein 0.0357 0.0463 0.0455
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0357 0.0463 0.0455
Loa Loa (eye worm) hypothetical protein 0.1034 0.1754 0.1747
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.184 0.329 0.3285
Trichomonas vaginalis PIKK family atypical protein kinase 0.5359 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2911 0.5332 0.5332
Leishmania major phosphatidylinositol kinase, putative 0.0357 0.0463 0.0455
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0357 0.0463 0.0455
Loa Loa (eye worm) hypothetical protein 0.0677 0.1073 0.1066
Leishmania major hypothetical protein, unknown function 0.0357 0.0463 0.0455
Trichomonas vaginalis fk506-binding protein, putative 0.0118 0.0009 0.0009
Trichomonas vaginalis PIKK family atypical protein kinase 0.4272 0.7928 0.7928
Leishmania major phosphatidylinositol kinase related protein, putative 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.2915 0.534 0.534
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0118 0.0009 0.5
Toxoplasma gondii non-specific serine/threonine protein kinase 0.1151 0.1977 0.2181
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.5359 1 1
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.0455
Trichomonas vaginalis conserved hypothetical protein 0.0794 0.1297 0.1297
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0566 0.0862 0.0854
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0357 0.0463 0.9166
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.1046 0.1776 0.1776
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.9166
Onchocerca volvulus 0.0357 0.0463 0.5
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0423 0.0589 0.0581
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.049 0.0717 0.0709
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.5359 1 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.5359 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0357 0.0463 0.0455
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0357 0.0463 0.0455
Schistosoma mansoni hypothetical protein 0.0794 0.1297 0.129
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.4276 0.7936 0.7934
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Trichomonas vaginalis PIKK family atypical protein kinase 0.3595 0.6637 0.6637
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0357 0.0463 0.0455
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.1034 0.1754 0.1747
Trichomonas vaginalis immunophilin, putative 0.0118 0.0009 0.0009
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.3204 0.589 0.589
Toxoplasma gondii target of rapamycin (TOR), putative 0.3998 0.7404 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2911 0.5332 0.5332
Entamoeba histolytica hypothetical protein 0.0357 0.0463 0.0455
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0379 0.0505 0.0497
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0379 0.0505 0.006
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0357 0.0463 0.0455
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0379 0.0505 0.0497
Trichomonas vaginalis PIKK family atypical protein kinase 0.0357 0.0463 0.0463
Trichomonas vaginalis PIKK family atypical protein kinase 0.5359 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Trichomonas vaginalis PIKK family atypical protein kinase 0.0357 0.0463 0.0463
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.1034 0.1754 0.1747
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0379 0.0505 0.0497
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.1883 0.3373 0.3368
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0756 0.1224 0.1216
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.9166
Entamoeba histolytica hypothetical protein 0.1034 0.1754 0.1747
Giardia lamblia Phosphatidylinositol 4-kinase 0.0357 0.0463 0.0455
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0566 0.0862 0.0862
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0566 0.0862 0.0854
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.019 0.0145 0.0137
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.5359 1 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.4276 0.7936 0.7934
Loa Loa (eye worm) hypothetical protein 0.1151 0.1977 0.1971
Loa Loa (eye worm) hypothetical protein 0.049 0.0717 0.0709
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0122 0.0015 0.0007
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0446 0.0633 0.0625
Echinococcus multilocularis 0.0357 0.0463 0.0455
Trichomonas vaginalis conserved hypothetical protein 0.1151 0.1977 0.1977
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.5359 1 1
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0209 0.0182 0.0173
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0122 0.0015 0.0007
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.1883 0.3373 0.3368
Trichomonas vaginalis PIKK family atypical protein kinase 0.1828 0.3268 0.3268
Trichomonas vaginalis PIKK family atypical protein kinase 0.3204 0.589 0.589
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1883 0.3373 0.3368
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0423 0.0589 0.0589
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1034 0.1754 0.1747
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.5359 1 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0423 0.0589 0.0589
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.5359 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1828 0.3268 0.3268
Mycobacterium tuberculosis Conserved hypothetical protein 0.0357 0.0463 0.5
Echinococcus granulosus serine:threonine protein kinase SMG1 0.1034 0.1754 0.1747
Trichomonas vaginalis PIKK family atypical protein kinase 0.4272 0.7928 0.7928
Leishmania major phosphatidylinositol 4-kinase, putative 0.0357 0.0463 0.0455
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.1883 0.3373 0.3368
Toxoplasma gondii FATC domain-containing protein 0.1034 0.1754 0.1859
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0379 0.0505 0.0497
Plasmodium vivax hypothetical protein 0.0357 0.0463 0.9166
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.1883 0.3373 0.3368
Leishmania major hypothetical protein, conserved 0.0457 0.0654 0.0646
Brugia malayi FAT domain containing protein 0.0794 0.1297 0.129
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.1883 0.3373 0.3368
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1034 0.1754 0.1747
Schistosoma mansoni hypothetical protein 0.0357 0.0463 0.0455
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0357 0.0463 0.0455
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0423 0.0589 0.0581
Trichomonas vaginalis PIKK family atypical protein kinase 0.1034 0.1754 0.1754
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0566 0.0862 0.0854
Trichomonas vaginalis PIKK family atypical protein kinase 0.4272 0.7928 0.7928
Onchocerca volvulus 0.0357 0.0463 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0357 0.0463 0.0455
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.1034 0.1754 0.1747
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0639 0.1001 0.0993
Giardia lamblia Hypothetical protein 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.2915 0.534 0.534
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0379 0.0505 0.0497
Entamoeba histolytica hypothetical protein 0.0522 0.0778 0.077
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.5359 1 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0423 0.0589 0.0581
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0118 0.0009 0.0009
Trichomonas vaginalis PIKK family atypical protein kinase 0.3189 0.5863 0.5863
Plasmodium vivax hypothetical protein, conserved 0.0357 0.0463 0.9166
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.2911 0.5332 0.5332
Schistosoma mansoni voltage-gated potassium channel 0.0133 0.0037 0.0028
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0522 0.0778 0.077
Trichomonas vaginalis conserved hypothetical protein 0.0677 0.1073 0.1073
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0379 0.0505 0.0505
Trichomonas vaginalis PIKK family atypical protein kinase 0.3204 0.589 0.589
Loa Loa (eye worm) hypothetical protein 0.0794 0.1297 0.129
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0379 0.0505 0.0497
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0756 0.1224 0.1216
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0566 0.0862 0.0854
Trypanosoma cruzi target of rapamycin kinase 3 0.4276 0.7936 0.7934
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0379 0.0505 0.0497
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.5359 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.184 0.329 0.329
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0379 0.0505 0.0505
Trichomonas vaginalis PIKK family atypical protein kinase 0.4565 0.8486 0.8486
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.0357 0.0463 0.0455
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0379 0.0505 1
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0379 0.0505 0.0497
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0379 0.0505 0.0497
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.2527 0.46 0.4595
Loa Loa (eye worm) phosphatidylinositol 3 0.0357 0.0463 0.0455
Trichomonas vaginalis PIKK family atypical protein kinase 0.4272 0.7928 0.7928
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0566 0.0862 0.0862
Loa Loa (eye worm) phosphatidylinositol kinase 0.0357 0.0463 0.0455
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.049 0.0717 0.0709
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.0357 0.0463 0.9166
Loa Loa (eye worm) phosphatidylinositol 3 0.0357 0.0463 0.0455
Echinococcus granulosus serine protein kinase ATM 0.1034 0.1754 0.1747
Trichomonas vaginalis PIKK family atypical protein kinase 0.1034 0.1754 0.1754
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0677 0.1073 0.1066
Trichomonas vaginalis PIKK family atypical protein kinase 0.3998 0.7404 0.7404
Trichomonas vaginalis PIKK family atypical protein kinase 0.2915 0.534 0.534
Leishmania major phosphatidylinositol 3-kinase, putative 0.0379 0.0505 0.0497
Loa Loa (eye worm) phosphatidylinositol 3 0.0357 0.0463 0.0455
Loa Loa (eye worm) phosphatidylinositol 3 0.5359 1 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0423 0.0589 0.0589
Loa Loa (eye worm) phosphatidylinositol 3 0.184 0.329 0.3285
Echinococcus multilocularis serine protein kinase ATM 0.1034 0.1754 0.1747
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.0357 0.0463 0.0455
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0379 0.0505 0.0497
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0423 0.0589 0.0581
Trichomonas vaginalis PIKK family atypical protein kinase 0.2915 0.534 0.534
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0794 0.1297 0.129
Trichomonas vaginalis PIKK family atypical protein kinase 0.4272 0.7928 0.7928
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.0357 0.0463 0.9166
Trichomonas vaginalis PIKK family atypical protein kinase 0.144 0.2527 0.2527
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0379 0.0505 0.0497
Trichomonas vaginalis PIKK family atypical protein kinase 0.3189 0.5863 0.5863
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0357 0.0463 0.0463
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0357 0.0463 0.0463
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0379 0.0505 0.006
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0122 0.0015 0.0007
Trichomonas vaginalis PIKK family atypical protein kinase 0.3478 0.6413 0.6413
Loa Loa (eye worm) hypothetical protein 0.1083 0.1847 0.184
Trichomonas vaginalis PIKK family atypical protein kinase 0.0677 0.1073 0.1073
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0756 0.1224 0.1216
Schistosoma mansoni voltage-gated potassium channel 0.0133 0.0037 0.0028
Leishmania major phosphatidylinositol 3-kinase, putative 0.1828 0.3268 0.3262
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0498 0.0733 0.0733
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0423 0.0589 0.0581
Leishmania major phosphatidylinositol 3-related kinase, putative 0.184 0.329 0.3285
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.5359 1 1
Entamoeba histolytica protein kinase rad3, putative 0.1034 0.1754 0.1747
Giardia lamblia GTOR 0.5359 1 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0401 0.0547 0.0539

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.842 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) -4.803 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) -4.787 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) -4.76 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) -4.69 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
GI50 (functional) -4.632 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) -4.434 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) -4.399 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) -4.343 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) -4.172 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) -4.115 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

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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