TDR Targets

Basic information

Technical information

TDR Targets ID: 177920
Name: N-(2,6-dimethylphenyl)acridin-9-amine
MW: 298.381 | Formula: C21H18N2
H donors: 1 H acceptors: 1 LogP: 5.8 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Cc1cccc(c1Nc1c2ccccc2nc2c1cccc2)C
InChi: 1S/C21H18N2/c1-14-8-7-9-15(2)20(14)23-21-16-10-3-5-12-18(16)22-19-13-6-4-11-17(19)21/h3-13H,1-2H3,(H,22,23)
InChiKey: FRHBUIKVKYWTEN-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

N-(2,6-dimethylphenyl)-9-acridinamine
acridin-9-yl-(2,6-dimethylphenyl)amine

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.1122	0.1674	0.1654
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3915	0.6607	0.6606
Loa Loa (eye worm)	hypothetical protein	0.0863	0.1216	0.1195
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.4655	0.7915	0.7833
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1133	0.1693	0.1691
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0579	0.0714	0.0685
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0387	0.0375	0.0352
Loa Loa (eye worm)	phosphatidylinositol 3	0.0387	0.0375	0.0352
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0863	0.1216	0.1195
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.125	0.1899	0.2177
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.5836	1	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.5836	1	1
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.5836	1	1
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0387	0.0375	0.0352
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0447	0.0481	0.0111
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0509	0.0591	0.0569
Schistosoma mansoni	hypothetical protein	0.0387	0.0375	0.0322
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0579	0.0714	0.0353
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0387	0.0375	0.0375
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0754	0.1023	0.0974
Entamoeba histolytica	hypothetical protein	0.1122	0.1674	0.1648
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0579	0.0714	0.0353
Trichomonas vaginalis	conserved hypothetical protein	0.125	0.1899	0.1898
Giardia lamblia	GTOR	0.5836	1	1
Trypanosoma cruzi	target of rapamycin kinase 3	0.4655	0.7915	0.7833
Toxoplasma gondii	target of rapamycin (TOR), putative	0.4351	0.7378	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0387	0.0375	0.0375
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3166	0.5284	0.5283
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3488	0.5853	0.5852
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0387	0.0375	0.0344
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0387	0.0375	0.0352
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Echinococcus granulosus	serine protein kinase ATM	0.1122	0.1674	0.1654
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.2036	0.3288	0.3027
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0407	0.041	0.0387
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0407	0.041	0.005
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0387	0.0375	0.0352
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.5836	1	1
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0407	0.041	0.0037
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0407	0.041	0.0357
Mycobacterium leprae	conserved hypothetical protein	0.0387	0.0375	0.5
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0407	0.041	0.0408
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1985	0.3198	0.3197
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.5836	1	1
Loa Loa (eye worm)	hypothetical protein	0.0736	0.0991	0.0969
Onchocerca volvulus		0.0387	0.0375	0.5
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.1133	0.1693	0.1667
Leishmania major	phosphatidylinositol 3-kinase, putative	0.1985	0.3198	0.2934
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0407	0.041	0.0387
Schistosoma mansoni	hypothetical protein	0.0863	0.1216	0.1168
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.2435	0.3993	0.3759
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0387	0.0375	0.0322
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0517	0.0605	0.0603
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0407	0.041	0.038
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5836	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0447	0.0481	0.0111
Entamoeba histolytica	hypothetical protein	0.0387	0.0375	0.0344
Loa Loa (eye worm)	hypothetical protein	0.1122	0.1674	0.1654
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.1996	0.3218	0.2954
Echinococcus multilocularis	serine protein kinase ATM	0.1122	0.1674	0.1654
Loa Loa (eye worm)	phosphatidylinositol 3	0.0387	0.0375	0.0352
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1985	0.3198	0.3197
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0188	0.0024	0.0024
Trichomonas vaginalis	PIKK family atypical protein kinase	0.465	0.7906	0.7906
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3171	0.5292	0.5291
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0736	0.0991	0.064
Loa Loa (eye worm)	phosphatidylinositol 3	0.0387	0.0375	0.0352
Echinococcus multilocularis		0.0387	0.0375	0.0352
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.5836	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3166	0.5284	0.5283
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0387	0.0375	0.0375
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0476	0.0533	0.0165
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0579	0.0714	0.0713
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0509	0.0591	0.0591
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.1122	0.1674	0.135
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0407	0.041	0.0037
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0646	0.0833	0.0811
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1122	0.1674	0.1672
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0407	0.041	0.0357
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0407	0.041	0.0408
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.5836	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0447	0.0481	0.0481
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0387	0.0375	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0736	0.0991	0.0989
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3171	0.5292	0.5291
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.1122	0.1674	0.135
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0387	0.0375	0.0373
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1122	0.1674	0.1674
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0387	0.0375	0.0373
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0447	0.0481	0.0479
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3171	0.5292	0.5291
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0407	0.041	0.038
Trichomonas vaginalis	PIKK family atypical protein kinase	0.465	0.7906	0.7906
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0863	0.1216	0.1195
Toxoplasma gondii	FATC domain-containing protein	0.1122	0.1674	0.1855
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.1996	0.3218	0.2954
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0407	0.041	0.0387
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0407	0.041	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4973	0.8475	0.8475
Loa Loa (eye worm)	phosphatidylinositol 3	0.1996	0.3218	0.3201
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0407	0.041	0.041
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5836	1	1
Echinococcus multilocularis	Zinc finger, PHD finger	0.0407	0.041	0.0387
Entamoeba histolytica	hypothetical protein	0.0387	0.0375	0.0344
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0509	0.0591	0.0569
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0579	0.0714	0.0713
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0387	0.0375	0.0352
Trichomonas vaginalis	PIKK family atypical protein kinase	0.465	0.7906	0.7906
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0407	0.041	0.0037
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.2753	0.4554	0.4342
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5836	1	1
Entamoeba histolytica	protein kinase rad3, putative	0.1122	0.1674	0.1648
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1996	0.3218	0.3216
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0447	0.0481	0.0429
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0427	0.0446	0.0074
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.5836	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.347	0.5821	0.582
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1567	0.246	0.2459
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0407	0.041	0.0387
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0517	0.0605	0.0603
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.1985	0.3198	0.2934
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0754	0.1023	0.1001
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0407	0.041	0.0408
Entamoeba histolytica	hypothetical protein	0.0387	0.0375	0.0344
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3787	0.6382	0.6381
Loa Loa (eye worm)	hypothetical protein	0.1181	0.1777	0.1757
Loa Loa (eye worm)	phosphatidylinositol 3	0.0713	0.0951	0.093
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.1122	0.1674	0.1654
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.2036	0.3288	0.3252
Loa Loa (eye worm)	phosphatidylinositol 3	0.0387	0.0375	0.0352
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0387	0.0375	0.0352
Trichomonas vaginalis	PIKK family atypical protein kinase	0.465	0.7906	0.7906
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.1122	0.1674	0.135
Loa Loa (eye worm)	phosphatidylinositol 3	0.5836	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1985	0.3198	0.3197
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.2036	0.3288	0.3272
Brugia malayi	FAT domain containing protein	0.0863	0.1216	0.1216
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0407	0.041	0.0037
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0387	0.0375	0.0373
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.2036	0.3288	0.3027
Leishmania major	hypothetical protein, conserved	0.0479	0.0537	0.0169
Loa Loa (eye worm)	hypothetical protein	0.125	0.1899	0.188
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.5836	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0469	0.052	0.049
Onchocerca volvulus		0.0387	0.0375	0.5
Loa Loa (eye worm)	hypothetical protein	0.0509	0.0591	0.0569
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.5836	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0447	0.0481	0.0451
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0447	0.0481	0.0451
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1122	0.1674	0.1674
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3488	0.5853	0.5852
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1985	0.3198	0.3197
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.2036	0.3288	0.3288
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.2036	0.3288	0.3272
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.0991	0.0989
Entamoeba histolytica	hypothetical protein	0.0539	0.0643	0.0613
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3166	0.5284	0.5283
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0387	0.0375	0.0322
Trichomonas vaginalis	PIKK family atypical protein kinase	0.347	0.5821	0.582
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0447	0.0481	0.0479
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0579	0.0714	0.0714
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.4655	0.7915	0.7833
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0754	0.1023	0.1001
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0407	0.041	1
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0407	0.041	0.005
Trichomonas vaginalis	conserved hypothetical protein	0.0863	0.1216	0.1214
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3488	0.5853	0.5852
Trichomonas vaginalis	PIKK family atypical protein kinase	0.465	0.7906	0.7906
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0387	0.0375	0.0322
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1122	0.1674	0.1672
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0447	0.0481	0.0479
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0579	0.0714	0.0713
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0387	0.0375	0.0373
Schistosoma mansoni	fkbp-rapamycin associated protein	0.1122	0.1674	0.1628
Loa Loa (eye worm)	hypothetical protein	0.0387	0.0375	0.0352
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0539	0.0643	0.0613
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4351	0.7378	0.7377
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.5836	1	1
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0407	0.041	0.0037
Trichomonas vaginalis	PIKK family atypical protein kinase	0.3171	0.5292	0.5291
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0646	0.0833	0.0811
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.1122	0.1674	0.1628

Activities

Activity type	Activity value	Assay description	Source	Reference
Log 1/D50 (functional)	< 3.05	Drug concentration in mole/kg/day providing 50% extension of life in intraperitoneally implanted leukemia L1210 mice.	ChEMBL.	7069706
Log 1/LD10 (ADMET)	= 3.05	Compound concentration in mole/kg/day lethal to 10% of mice	ChEMBL.	7069706

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

ChEMBL: CHEMBL110881
PubChem: 4127784

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 177920