Detailed information for compound 582228

Basic information

Technical information
  • TDR Targets ID: 582228
  • Name: (3,4-dimethylimidazo[4,5-f]quinolin-2-yl)amin e
  • MW: 212.25 | Formula: C12H12N4
  • H donors: 1 H acceptors: 2 LogP: 1.72 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cc2ncccc2c2c1n(C)c(n2)N
  • InChi: 1S/C12H12N4/c1-7-6-9-8(4-3-5-14-9)10-11(7)16(2)12(13)15-10/h3-6H,1-2H3,(H2,13,15)
  • InChiKey: GMGWMIJIGUYNAY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (3,4-dimethylpyrido[3,2-e]benzimidazol-2-yl)amine
  • 2-amino-3,4-dimethylimidazo(4,5-f)quinoline
  • 3,4-dimethylimidazo[4,5-f]quinolin-2-amine
  • 3,4-dimethyl-2-imidazo[4,5-f]quinolinamine
  • 3,4-dimethylpyrido[3,2-e]benzimidazol-2-amine
  • 3,4-dimethyl-2-pyrido[3,2-e]benzimidazolamine
  • 3,4-dimethyl-3H-imidazo[4,5-f]quinolin-2-amine
  • 3,4-Dimethyl-3H-imidazo(4,5-f)quinolin-2-amine
  • 3H-Imidazo(4,5-f)quinoline, 2-amino-3,4-dimethyl-
  • 77094-11-2
  • BRN 5039094
  • CCRIS 1768
  • Me IQ
  • MeIQ
  • MelQ
  • Methyl IQ
  • Methyl-IQ

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
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0017 0.1315 0.1199
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0024 0.2346 0.3826
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.2175 0.2071
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0009 0.0132 0.0215
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.1315 0.2144
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.1176 0.1918
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.6131 1
Toxoplasma gondii hypothetical protein 0.0026 0.264 0.2072
Loa Loa (eye worm) hypothetical protein 0.0023 0.2175 0.1837
Loa Loa (eye worm) hypothetical protein 0.0017 0.1315 0.0939
Mycobacterium leprae Polyketide synthase Pks13 0.0036 0.4114 0.4035
Loa Loa (eye worm) fatty acid synthase 0.0024 0.2298 0.1965
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0036 0.4114 0.6709
Brugia malayi AMP-binding enzyme family protein 0.0029 0.311 0.3104
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 1 1
Onchocerca volvulus Fatty acid synthase homolog 0.0044 0.5215 0.8673
Mycobacterium ulcerans polyketide synthase Pks9 0.0016 0.1135 0.1017
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.2175 0.5
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 1 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Mycobacterium ulcerans hypothetical protein 0.0023 0.2175 0.2071
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0024 0.2346 0.2339
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0024 0.2346 0.2244
Mycobacterium ulcerans thioesterase 0.002 0.175 0.164
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0017 0.1339 0.2184
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0024 0.2346 0.3826
Brugia malayi AMP-binding enzyme family protein 0.0023 0.2175 0.2168
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0076 1 0.5
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0026 0.264 0.2542
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0016 0.109 0.0402
Loa Loa (eye worm) hypothetical protein 0.0042 0.4915 0.4695
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.002 0.175 0.164
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.6131 0.608
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.2175 0.2071
Loa Loa (eye worm) hypothetical protein 0.0017 0.1315 0.0939
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0016 0.1135 0.1017
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0024 0.2346 0.2244
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.2568 0.4188
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.2175 0.2071
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0023 0.2236 0.3647
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.2175 0.5
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 1 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.2175 0.3548
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.001 0.0217 0.0353
Mycobacterium leprae Probable polyketide synthase Pks1 0.0026 0.2568 0.2469
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.6131 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 1 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0026 0.264 0.1526
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 1 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0026 0.264 0.1526
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0036 0.4114 0.6709
Mycobacterium ulcerans polyketide synthase Pks13 0.0036 0.4114 0.4035
Brugia malayi AMP-binding enzyme family protein 0.0023 0.2175 0.2168
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.2175 0.2071
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0023 0.2236 0.3647
Mycobacterium ulcerans thioesterase TesA 0.002 0.175 0.164
Onchocerca volvulus 0.0023 0.2175 0.3487
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.2346 0.2244
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0024 0.2346 0.3826
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0029 0.311 0.2812
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0029 0.311 0.5073
Toxoplasma gondii type I fatty acid synthase, putative 0.0017 0.1316 0.0645
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 1 1
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0009 0.0132 0.0215
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.2346 0.2244
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.2175 0.2071
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.2175 0.2071
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.2175 0.2071
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0026 0.2568 0.4188
Loa Loa (eye worm) hypothetical protein 0.0023 0.2175 0.1837
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.2175 0.5
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0019 0.1647 0.1536
Loa Loa (eye worm) hypothetical protein 0.0017 0.1315 0.0939
Brugia malayi AMP-binding enzyme family protein 0.0023 0.2175 0.2168
Mycobacterium tuberculosis Probable thioesterase TesA 0.002 0.175 0.2854
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0026 0.2568 0.2469
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.2175 0.2071
Onchocerca volvulus 0.0029 0.311 0.5083
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.1176 0.1918
Loa Loa (eye worm) hypothetical protein 0.0017 0.1315 0.0939
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 0.0132 0.0123
Mycobacterium ulcerans polyketide synthase 0.0026 0.2568 0.2469
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0019 0.1647 0.1536
Loa Loa (eye worm) hypothetical protein 0.0076 1 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 1 1
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0026 0.2568 0.4188
Loa Loa (eye worm) hypothetical protein 0.0023 0.2175 0.1837
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0026 0.2568 0.2469
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.2346 0.2244
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0014 0.0803 0.131
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.2568 0.2469
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0009 0.0132 0.0215
Loa Loa (eye worm) hypothetical protein 0.0017 0.1315 0.0939
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.002 0.1694 0.2763
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.1176 0.1918
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 1 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0024 0.2346 0.2244
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.2536 1
Mycobacterium ulcerans polyketide synthase 0.0024 0.2346 0.2244
Onchocerca volvulus 0.0049 0.5992 1
Toxoplasma gondii type I fatty acid synthase, putative 0.0027 0.2707 0.2144
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0026 0.2568 0.2469
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0016 0.1135 0.1017
Loa Loa (eye worm) hypothetical protein 0.0014 0.0774 0.0375
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.2175 0.3548
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0046 0.5546 0.5542
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.1176 0.1918
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0009 0.0132 0.0215
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0019 0.1647 0.1536
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.2175 0.2071

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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