Detailed information for compound 144360

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 361.115 | Formula: C13H7Cl2N4NaO3
  • H donors: 1 H acceptors: 3 LogP: 2.44 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1[N-]C(=O)N(C1)/N=C/c1ncc(o1)c1ccc(c(c1)Cl)Cl.[Na+]
  • InChi: 1S/C13H8Cl2N4O3.Na/c14-8-2-1-7(3-9(8)15)10-4-16-12(22-10)5-17-19-6-11(20)18-13(19)21;/h1-5H,6H2,(H,18,20,21);/q;+1/p-1/b17-5+;
  • InChiKey: JMNTZTSYNQNJAS-YAKHFBBESA-M  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0014 0.0323 0.0323
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0323 0.0664
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0157 0.0157
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0157 0.0157
Entamoeba histolytica acyl-CoA synthetase, putative 0.0048 0.1779 0.4036
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0157 0.0157
Entamoeba histolytica protein kinase domain containing protein 0.011 0.4408 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0157 0.0157
Trypanosoma brucei monoglyceride lipase, putative 0.008 0.3122 0.7082
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0323 0.0664
Leishmania major acetyl-CoA synthetase, putative 0.0014 0.0323 0.0664
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0157 0.0157
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0157 0.0157
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0157 0.0221
Onchocerca volvulus 0.0048 0.1779 0.4036
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.011 0.4408 0.6221
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0157 0.0157
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.1815 0.1815
Trichomonas vaginalis valacyclovir hydrolase, putative 0.008 0.3122 0.7082
Echinococcus multilocularis protein kinase shaggy 0.011 0.4408 0.4408
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0014 0.0323 0.0664
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Plasmodium vivax acyl-CoA synthetase, putative 0.0036 0.1258 0.2289
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.1174 0.2416
Plasmodium falciparum esterase, putative 0.008 0.3122 0.6852
Mycobacterium ulcerans aldehyde dehydrogenase 0.0121 0.4858 1
Schistosoma mansoni hypothetical protein 0.0173 0.7086 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Schistosoma mansoni thyroid hormone receptor 0.001 0.0157 0.0221
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.1779 0.3662
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0014 0.0323 0.0664
Loa Loa (eye worm) hypothetical protein 0.0048 0.1779 0.1779
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0121 0.4858 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0157 0.0157
Mycobacterium leprae POSSIBLE FATTY-ACID-CoA LIGASE FADD10 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0014 0.0323 0.1033
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0014 0.0323 0.0664
Schistosoma mansoni aldehyde dehydrogenase 0.0121 0.4858 0.6856
Plasmodium falciparum acyl-CoA synthetase 0.0036 0.1258 0.2289
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0036 0.1258 0.1258
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1706 0.2408
Entamoeba histolytica hypothetical protein 0.0037 0.1282 0.2907
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0014 0.0323 0.0323
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0036 0.1258 0.5
Loa Loa (eye worm) hypothetical protein 0.0036 0.1258 0.1258
Schistosoma mansoni coup transcription factor 0.001 0.0157 0.0221
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1706 0.1706
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0014 0.0323 0.0664
Brugia malayi ecdysteroid receptor 0.001 0.0157 0.0157
Mycobacterium ulcerans acetyl-CoA synthetase 0.0014 0.0323 0.0664
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.011 0.4408 0.4408
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0157 0.0157
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0157 0.0221
Schistosoma mansoni survival motor neuron protein 0.0049 0.1815 0.2561
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0157 0.0157
Mycobacterium ulcerans aldehyde dehydrogenase 0.0121 0.4858 1
Onchocerca volvulus 0.001 0.0157 0.0355
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0157 0.0157
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.1282 0.1809
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0048 0.1779 0.3662
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1706 0.1706
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.011 0.4408 1
Plasmodium falciparum glycogen synthase kinase 3 0.011 0.4408 1
Brugia malayi AMP-binding enzyme family protein 0.0048 0.1779 0.1779
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.1779 0.3662
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.1779 0.3662
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0048 0.1779 0.3662
Echinococcus multilocularis survival motor neuron protein 1 0.0241 1 1
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.1282 0.1282
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0157 0.0221
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0014 0.0323 0.0664
Entamoeba histolytica hypothetical protein 0.0037 0.1282 0.2907
Onchocerca volvulus 0.0014 0.0323 0.0732
Schistosoma mansoni aldehyde dehydrogenase 0.0121 0.4858 0.6856
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0157 0.0157
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0036 0.1258 0.2589
Brugia malayi AMP-binding enzyme family protein 0.0048 0.1779 0.1779
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0014 0.0323 0.0664
Onchocerca volvulus 0.0049 0.1815 0.4116
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0121 0.4858 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0157 0.0221
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0157 0.0157
Echinococcus granulosus protein kinase shaggy 0.011 0.4408 0.4408
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0157 0.0157
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Brugia malayi intracellular kinase 0.011 0.4408 0.4408
Echinococcus granulosus geminin 0.0173 0.7086 0.7086
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Loa Loa (eye worm) CMGC/GSK protein kinase 0.011 0.4408 0.4408
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0157 0.0157
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.1779 0.3662
Trichomonas vaginalis CMGC family protein kinase 0.011 0.4408 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0121 0.4858 0.4858
Trypanosoma brucei monoglyceride lipase, putative 0.008 0.3122 0.7082
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0048 0.1779 0.3662
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.008 0.3122 0.7082
Mycobacterium tuberculosis Possible lysophospholipase 0.008 0.3122 0.6426
Trichomonas vaginalis CMGC family protein kinase 0.011 0.4408 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.1706 0.1706
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0323 0.0664
Entamoeba histolytica acyl-coA synthetase, putative 0.0048 0.1779 0.4036
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0014 0.0323 0.0732
Plasmodium vivax glycogen synthase kinase 3, putative 0.011 0.4408 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0121 0.4858 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0157 0.0221
Mycobacterium leprae POSSIBLE O-SUCCINYLBENZOIC ACID--CoA LIGASE MENE (OSB-CoA SYNTHETASE) (O-SUCCINYLBENZOATE-CoA SYNTHASE) 0.0014 0.0323 0.1033
Schistosoma mansoni hypothetical protein 0.0037 0.1282 0.1809
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0157 0.0157
Entamoeba histolytica protein kinase, putative 0.011 0.4408 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Plasmodium vivax PST-A protein 0.008 0.3122 0.6852
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0014 0.0323 0.0732
Plasmodium falciparum lysophospholipase, putative 0.008 0.3122 0.6852
Entamoeba histolytica acyl-CoA synthetase, putative 0.0048 0.1779 0.4036
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0036 0.1258 0.1258
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3122 0.7082
Brugia malayi nuclear receptor NHR-88 0.001 0.0157 0.0157
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0157 0.0157
Echinococcus granulosus FTZ F1 alpha 0.001 0.0157 0.0157
Treponema pallidum gamma-glutamyl phosphate reductase 0.0007 0 0.5
Schistosoma mansoni hypothetical protein 0.0173 0.7086 1
Brugia malayi steroid hormone receptor 0.001 0.0157 0.0157
Brugia malayi AMP-binding enzyme family protein 0.0048 0.1779 0.1779
Brugia malayi nuclear hormone receptor 0.001 0.0157 0.0157
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3122 0.7082
Onchocerca volvulus 0.011 0.4408 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.1258 0.1258
Giardia lamblia Kinase, CMGC GSK 0.011 0.4408 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0157 0.0221
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0157 0.0157
Plasmodium falciparum lysophospholipase, putative 0.008 0.3122 0.6852
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0157 0.0157
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0323 0.0732
Leishmania major monoglyceride lipase, putative 0.008 0.3122 0.6426
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0036 0.1258 0.2589
Mycobacterium ulcerans O-succinylbenzoic acid--CoA ligase 0.0014 0.0323 0.0664
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.1174 0.2416
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.011 0.4408 0.9074
Schistosoma mansoni hypothetical protein 0.0049 0.1815 0.2561
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0157 0.0157
Giardia lamblia Kinase, CMGC GSK 0.011 0.4408 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Leishmania major acetyl-CoA synthetase, putative 0.0014 0.0323 0.0664
Leishmania major long-chain-fatty-acid-CoA ligase, putative 0.0014 0.0323 0.0664
Mycobacterium ulcerans hypothetical protein 0.008 0.3122 0.6426
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0014 0.0323 0.0664
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0157 0.0157
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.1779 0.3662
Mycobacterium tuberculosis PROBABLE FATTY-ACID-CoA LIGASE FADD18 (FRAGMENT) (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0012 0.0238 0.0491
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.008 0.3122 1
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0014 0.0323 0.0323
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0014 0.0323 0.0664
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0014 0.0323 0.0664
Schistosoma mansoni thyroid hormone receptor 0.001 0.0157 0.0221
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative 0.0014 0.0323 0.0732
Entamoeba histolytica hypothetical protein 0.0037 0.1282 0.2907
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0157 0.0157
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0014 0.0323 0.0664
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0014 0.0323 0.0664
Mycobacterium ulcerans bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase 0.0014 0.0323 0.0664
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1706 0.2408
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0157 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0157 0.0157
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0157 0.0157
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.1174 0.2416
Trichomonas vaginalis conserved hypothetical protein 0.008 0.3122 0.7082
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1706 0.1706
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0157 0.0157
Loa Loa (eye worm) oxidoreductase 0.0014 0.0323 0.0323
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0157 0.0355
Trypanosoma cruzi monoglyceride lipase, putative 0.008 0.3122 0.7082
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0157 0.0157
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0014 0.0323 0.0732
Mycobacterium ulcerans hypothetical protein 0.0048 0.1779 0.3662
Echinococcus granulosus glycogen synthase kinase 3 beta 0.011 0.4408 0.4408
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3122 0.7082
Plasmodium falciparum lysophospholipase, putative 0.008 0.3122 0.6852
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.011 0.4408 0.9074
Schistosoma mansoni nuclear hormone receptor 0.001 0.0157 0.0221
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0121 0.4858 0.4858
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3122 0.7082
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0048 0.1779 0.3662
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0157 0.0157
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0157 0.0157
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0157 0.0355
Toxoplasma gondii Acetyl-coenzyme A synthetase 2, putative 0.0014 0.0323 0.0664
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.1779 0.3662
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1706 0.2408
Onchocerca volvulus 0.0014 0.0323 0.0732
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0048 0.1779 0.3662
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1706 0.1706
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Trypanosoma brucei protein kinase, putative 0.011 0.4408 1
Trichomonas vaginalis conserved hypothetical protein 0.008 0.3122 0.7082
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Onchocerca volvulus 0.0014 0.0323 0.0732
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0048 0.1779 0.3662
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0157 0.0157
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.1282 0.1282
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0323 0.0664
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0157 0.0157
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0323 0.0323
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0014 0.0323 0.0664
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0157 0.0157
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0048 0.1779 0.5699
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0323 0.0732
Brugia malayi hypothetical protein 0.0037 0.1282 0.1282
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Mycobacterium ulcerans lysophospholipase 0.008 0.3122 0.6426
Toxoplasma gondii propionate-CoA ligase 0.0014 0.0323 0.0664
Loa Loa (eye worm) hypothetical protein 0.0241 1 1
Echinococcus multilocularis geminin 0.0173 0.7086 0.7086
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0157 0.0221
Brugia malayi acetyl-Coenzyme A synthetase 2 0.0014 0.0323 0.0323
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0157 0.0157
Entamoeba histolytica protein kinase domain containing protein 0.011 0.4408 1
Wolbachia endosymbiont of Brugia malayi bifunctional proline dehydrogenase/pyrroline-5-carboxylate dehydrogenase 0.0007 0 0.5
Entamoeba histolytica hypothetical protein 0.0037 0.1282 0.2907
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.008 0.3122 0.7082
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0157 0.0221
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) 0.0014 0.0323 0.1033
Loa Loa (eye worm) hypothetical protein 0.0014 0.0323 0.0323
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0157 0.0157
Trypanosoma brucei acetyl-CoA synthetase, putative 0.0014 0.0323 0.0732
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0157 0.0355
Loa Loa (eye worm) hypothetical protein 0.0036 0.1258 0.1258
Toxoplasma gondii aldehyde dehydrogenase 0.0121 0.4858 1
Trypanosoma brucei long-chain-fatty-acid-CoA ligase, putative 0.0014 0.0323 0.0732
Onchocerca volvulus 0.0018 0.049 0.1113
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0014 0.0323 0.0664
Mycobacterium ulcerans acyl-CoA synthetase 0.0014 0.0323 0.0664
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.1174 0.2416
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0014 0.0323 0.0732
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0157 0.0157
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0157 0.0157
Schistosoma mansoni acetyl-CoA synthetase 0.0014 0.0323 0.0455
Loa Loa (eye worm) hypothetical protein 0.001 0.0157 0.0157
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0014 0.0323 0.0664
Loa Loa (eye worm) CMGC/GSK protein kinase 0.011 0.4408 0.4408
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0157 0.0221
Loa Loa (eye worm) hypothetical protein 0.0048 0.1779 0.1779
Echinococcus granulosus survival motor neuron protein 1 0.0241 1 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.1779 0.1779
Loa Loa (eye worm) hypothetical protein 0.0014 0.0323 0.0323
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.1706 0.1706
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0157 0.0157
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0157 0.0157
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3122 0.7082
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0048 0.1779 0.5699

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 0 Skeletal muscle relaxant activity expressed as Muscle relaxant activity grade at HTD in mice;1=slight activity ChEMBL. 3806610
HTD (functional) > 800 mg kg-1 Highest tolerated dose (p.o.) in mice. ChEMBL. 3806610
HTD (functional) > 800 mg kg-1 Highest tolerated dose (p.o.) in mice. ChEMBL. 3806610
Inhibition (functional) = -71 % Inhibition of gastrocnemius twitch tension after a cumulative dose of 36.6 mg/kg iv in rats. ChEMBL. 3806610

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

1 literature reference was collected for this gene.

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