Detailed information for compound 234486

Basic information

Technical information
  • TDR Targets ID: 234486
  • Name: 6-nonylsulfanyl-3,4-diphenylpyridazine
  • MW: 390.584 | Formula: C25H30N2S
  • H donors: 0 H acceptors: 2 LogP: 7.94 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCCSc1nnc(c(c1)c1ccccc1)c1ccccc1
  • InChi: 1S/C25H30N2S/c1-2-3-4-5-6-7-14-19-28-24-20-23(21-15-10-8-11-16-21)25(27-26-24)22-17-12-9-13-18-22/h8-13,15-18,20H,2-7,14,19H2,1H3
  • InChiKey: QNZPVBGJYVIDTC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-nonylsulfanyl-3,4-diphenyl-pyridazine
  • 6-(nonylthio)-3,4-diphenylpyridazine
  • 6-(nonylthio)-3,4-diphenyl-pyridazine
  • 6-nonylsulfanyl-3,4-di(phenyl)pyridazine
  • 6-(nonylthio)-3,4-di(phenyl)pyridazine

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 tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0007 0.0012 0.0044
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.0018 0.0146 0.0274
Trypanosoma cruzi hypothetical protein, conserved 0.001 0.0048 0.1028
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0056 0.0091
Brugia malayi AMP-binding enzyme family protein 0.0024 0.022 0.0427
Brugia malayi notch-like transmembrane receptor 0.0079 0.0906 0.1832
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0056 0.0091
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0246 0.6707
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0134 0.0494
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0048 0.012
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0312 0.03
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0056 0.0091
Trypanosoma cruzi hypothetical protein, conserved 0.001 0.0048 0.1028
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0007 0.0012 0.0044
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0224 0.2705 1
Brugia malayi Cadherin domain containing protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.001 0.0048 0.012
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Schistosoma mansoni chromosome transmission fidelity factor 0.001 0.0048 0.0073
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0048 0.012
Echinococcus granulosus replication factor c subunit 1 0.001 0.0048 0.0073
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.022 0.0427
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.022 0.183
Onchocerca volvulus 0.0079 0.0906 0.1832
Onchocerca volvulus 0.0079 0.0906 0.1832
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0056 0.0091
Loa Loa (eye worm) blistered cuticle protein 3 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Onchocerca volvulus 0.04 0.489 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0056 0.0044
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0056 0.0091
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0056 0.0091
Schistosoma mansoni laminin gamma-3 chain 0.0079 0.0906 0.1832
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.001 0.0048 0.1028
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Onchocerca volvulus 0.0031 0.0312 0.0615
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0117 0.3016
Loa Loa (eye worm) RNA binding protein 0.0063 0.0713 0.1436
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Brugia malayi steroid hormone receptor 0.0011 0.0056 0.0091
Treponema pallidum DNA ligase (lig) 0.001 0.0048 0.5
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0361 0.0714
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0361 0.1333
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.045 0.1471
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Onchocerca volvulus 0.0035 0.0361 0.0714
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0361 0.0714
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0361 1
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Toxoplasma gondii ABC1 family protein 0.0035 0.0361 0.3899
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0056 0.0091
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0361 0.1169
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Trypanosoma cruzi FHA domain containing protein, putative 0.001 0.0048 0.1028
Schistosoma mansoni hypothetical protein 0.0041 0.0432 0.086
Onchocerca volvulus 0.0079 0.0906 0.1832
Toxoplasma gondii EGF family domain-containing protein 0.0079 0.0906 1
Brugia malayi nuclear receptor NHR-88 0.0011 0.0056 0.0091
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Echinococcus granulosus protein jagged 2 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0361 0.1333
Onchocerca volvulus 0.0079 0.0906 0.1832
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.001 0.0048 0.012
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0117 0.1176
Onchocerca volvulus 0.0011 0.0056 0.0091
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0246 0.6707
Loa Loa (eye worm) hypothetical protein 0.0024 0.022 0.0427
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0312 0.03
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0056 0.0091
Onchocerca volvulus Dual oxidase homolog 0.04 0.489 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0056 0.0091
Echinococcus multilocularis flap endonuclease 1 0.0026 0.0246 0.0234
Brugia malayi Cadherin domain containing protein 0.0079 0.0906 0.1832
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0361 0.0349
Plasmodium falciparum flap endonuclease 1 0.0026 0.0246 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0056 0.0091
Schistosoma mansoni patched 1 0.0042 0.045 0.0899
Brugia malayi hypothetical protein 0.0167 0.1994 0.4064
Leishmania major hypothetical protein, conserved 0.0035 0.0361 1
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0361 1
Mycobacterium leprae Probable lipase LipE 0.0035 0.0361 1
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.001 0.0048 0.5
Echinococcus granulosus neurogenic locus notch protein 0.0079 0.0906 0.1832
Entamoeba histolytica hypothetical protein 0.001 0.0048 0.0315
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0007 0.0012 0.0044
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0146 0.5716
Schistosoma mansoni niemann-pick C1 (NPC1) 0.01 0.1168 0.2369
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Brugia malayi Animal haem peroxidase family protein 0.04 0.489 1
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.001 0.0048 0.0401
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Echinococcus multilocularis expressed conserved protein 0.0093 0.1075 0.1064
Trichomonas vaginalis set domain proteins, putative 0.0247 0.2993 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.022 0.5971
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Trichomonas vaginalis esterase, putative 0.0035 0.0361 0.1169
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0146 0.0538
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0056 0.0091
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0056 0.0091
Echinococcus granulosus fibropellin Ia 0.0079 0.0906 0.1832
Echinococcus multilocularis Niemann Pick C1 protein 0.0099 0.1149 0.1138
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0056 0.0091
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.022 0.5971
Mycobacterium ulcerans hypothetical protein 0.0035 0.0361 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0361 0.1333
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0312 0.0615
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0361 1
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0048 0.012
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Mycobacterium leprae PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+]) 0.001 0.0048 0.1028
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0361 0.1169
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0117 0.3016
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0056 0.0091
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0713 0.1436
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0361 0.0714
Loa Loa (eye worm) hypothetical protein 0.0167 0.1994 0.4064
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.022 0.5971
Echinococcus granulosus nibrin 0.001 0.0048 0.0073
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0312 0.0615
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0361 0.1169
Giardia lamblia High cysteine protein 0.0079 0.0906 1
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0361 0.1333
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Echinococcus multilocularis protein patched 0.0042 0.045 0.0439
Entamoeba histolytica Flap nuclease, putative 0.0026 0.0246 0.2056
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0117 0.0215
Echinococcus granulosus tar DNA binding protein 0.0063 0.0713 0.1436
Schistosoma mansoni flap endonuclease-1 0.0023 0.0215 0.0416
Brugia malayi hypothetical protein 0.001 0.0048 0.0073
Brugia malayi beta-lactamase family protein 0.0035 0.0361 0.0714
Loa Loa (eye worm) animal heme peroxidase 0.04 0.489 1
Brugia malayi Delta serrate ligand family protein 0.0079 0.0906 0.1832
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0361 1
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0146 0.3834
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Schistosoma mansoni cell polarity protein 0.0079 0.0906 0.1832
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0056 0.0091
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0246 0.6707
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0056 0.0091
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Schistosoma mansoni hypothetical protein 0.0034 0.0348 0.0688
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0246 0.6707
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0056 0.0091
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Schistosoma mansoni hypothetical protein 0.0041 0.0432 0.086
Schistosoma mansoni DNA ligase IV 0.001 0.0048 0.0073
Schistosoma mansoni peroxidasin 0.04 0.489 1
Brugia malayi Pre-SET motif family protein 0.0031 0.0312 0.0615
Loa Loa (eye worm) hypothetical protein 0.0018 0.0146 0.0274
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.022 0.183
Echinococcus multilocularis neurogenic locus protein delta 0.0079 0.0906 0.0895
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0048 0.012
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0056 0.0091
Loa Loa (eye worm) animal heme peroxidase 0.04 0.489 1
Brugia malayi ecdysteroid receptor 0.0011 0.0056 0.0091
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.022 0.5971
Brugia malayi Peroxidasin 0.04 0.489 1
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0056 0.0091
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0056 0.0091
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0048 0.012
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0015 0.0117 0.0433
Loa Loa (eye worm) hypothetical protein 0.0018 0.0146 0.0274
Brugia malayi CHE-14 protein 0.0042 0.045 0.0899
Onchocerca volvulus 0.04 0.489 1
Brugia malayi hypothetical protein 0.001 0.0048 0.0073
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0361 1
Brugia malayi AMP-binding enzyme family protein 0.0024 0.022 0.0427
Echinococcus multilocularis protein dispatched 1 0.0048 0.0525 0.0513
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Echinococcus multilocularis neurogenic locus protein delta 0.0079 0.0906 0.0895
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0056 0.0044
Loa Loa (eye worm) TAR-binding protein 0.0063 0.0713 0.1436
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0056 0.0091
Brugia malayi Niemann-Pick C1 protein precursor 0.0099 0.1149 0.233
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0056 0.0044
Onchocerca volvulus 0.04 0.489 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0146 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0056 0.0044
Echinococcus multilocularis protein jagged 2 0.0079 0.0906 0.0895
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0079 0.0906 0.1832
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0056 0.0091
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0056 0.0091
Echinococcus granulosus protein jagged 1 0.0079 0.0906 0.1832
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0312 0.0615
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0012 0.0044
Loa Loa (eye worm) hypothetical protein 0.0035 0.0361 0.0714
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0056 0.0091
Echinococcus granulosus Niemann Pick C1 protein 0.0141 0.1674 0.3406
Onchocerca volvulus Peroxidasin homolog 0.04 0.489 1
Echinococcus multilocularis tar DNA binding protein 0.0063 0.0713 0.0701
Brugia malayi Flap endonuclease-1 0.0026 0.0246 0.0479
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0007 0.0012 0.0044
Schistosoma mansoni slit 0.0079 0.0906 0.1832
Onchocerca volvulus Peroxidasin homolog 0.04 0.489 1
Echinococcus multilocularis neurogenic locus notch protein 0.0079 0.0906 0.0895
Brugia malayi Calcium binding EGF domain containing protein 0.0079 0.0906 0.1832
Brugia malayi RNA binding protein 0.0063 0.0713 0.1436
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.0713 0.1436
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Trichomonas vaginalis replication factor C large subunit, putative 0.001 0.0048 0.012
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Schistosoma mansoni peroxidasin 0.04 0.489 1
Loa Loa (eye worm) Notch2 0.0079 0.0906 0.1832
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0056 0.0091
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.022 0.5971
Brugia malayi Animal haem peroxidase family protein 0.04 0.489 1
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0079 0.0906 0.1832
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.0713 0.1436
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.001 0.0048 0.1028
Echinococcus granulosus flap endonuclease 1 0.0026 0.0246 0.0479
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Onchocerca volvulus 0.0034 0.0348 0.0688
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0134 0.0494
Loa Loa (eye worm) hypothetical protein 0.0018 0.0146 0.0274
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0146 0.3834
Schistosoma mansoni septate junction protein 0.0079 0.0906 0.1832
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Loa Loa (eye worm) hypothetical protein 0.0052 0.0569 0.1141
Echinococcus granulosus neurogenic locus notch protein 4 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0056 0.0091
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0361 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0361 0.1333
Loa Loa (eye worm) notch protein 0.0079 0.0906 0.1832
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.022 0.5971
Echinococcus multilocularis protein jagged 1 0.0079 0.0906 0.0895
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0056 0.0091
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0361 0.0714
Schistosoma mansoni topbp1 0.001 0.0048 0.0073
Onchocerca volvulus 0.0035 0.0361 0.0714
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0298 0.0586
Onchocerca volvulus 0.0024 0.022 0.0427
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0056 0.0091
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.001 0.0048 0.0073
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Loa Loa (eye worm) animal heme peroxidase 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.045 0.0899
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Echinococcus granulosus protein jagged 1 0.0079 0.0906 0.1832
Brugia malayi Muscle positioning protein 4 0.0079 0.0906 0.1832
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0117 0.0215
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0056 0.0044
Echinococcus multilocularis nibrin 0.001 0.0048 0.0036
Schistosoma mansoni hypothetical protein 0.0041 0.0432 0.086
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0117 0.0105
Schistosoma mansoni notch 0.0079 0.0906 0.1832
Echinococcus multilocularis sterol regulatory element binding protein 0.0042 0.045 0.0439
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0012 0.0044
Brugia malayi Pre-SET motif family protein 0.0217 0.2621 0.5349
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0056 0.0091
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0056 0.0091
Onchocerca volvulus 0.0035 0.0361 0.0714
Plasmodium falciparum replication factor C subunit 1, putative 0.001 0.0048 0.1533
Loa Loa (eye worm) animal heme peroxidase 0.04 0.489 1
Echinococcus granulosus sterol regulatory element binding protein 0.0042 0.045 0.0899
Schistosoma mansoni coup transcription factor 0.0011 0.0056 0.0091
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0007 0.0012 0.0044
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0056 0.0044
Onchocerca volvulus 0.001 0.0048 0.0073
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0312 0.0615
Brugia malayi DKFZp564C0469 protein 0.001 0.0048 0.0073
Echinococcus multilocularis neurogenic locus notch protein 0.0079 0.0906 0.0895
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0056 0.0091
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0117 0.0215
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Plasmodium vivax replication factor C subunit 1, putative 0.001 0.0048 0.1028
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0056 0.0091
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.022 0.5971
Echinococcus multilocularis notch 0.0079 0.0906 0.0895
Schistosoma mansoni topbp1 0.001 0.0048 0.0073
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.0099 0.1149 0.233
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0713 0.1436
Echinococcus multilocularis protein jagged 1 0.0079 0.0906 0.0895
Echinococcus granulosus delta-like protein 1 0.0079 0.0906 0.1832
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0056 0.0091
Echinococcus granulosus Niemann Pick C1 protein 0.0099 0.1149 0.233
Brugia malayi topoisomerase 0.001 0.0048 0.0073
Brugia malayi Calcium binding EGF domain containing protein 0.0079 0.0906 0.1832
Onchocerca volvulus Putative cubilin 0.0079 0.0906 0.1832
Brugia malayi GCC2 and GCC3 family protein 0.0079 0.0906 0.1832
Onchocerca volvulus Chorion peroxidase homolog 0.04 0.489 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0361 1
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0048 0.012
Onchocerca volvulus 0.0247 0.2993 0.6112
Schistosoma mansoni hypothetical protein 0.0041 0.0432 0.086
Echinococcus multilocularis slit 2 protein 0.0079 0.0906 0.0895
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0056 0.0091
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Brugia malayi Animal haem peroxidase family protein 0.04 0.489 1
Onchocerca volvulus 0.0079 0.0906 0.1832
Brugia malayi TAR-binding protein 0.0063 0.0713 0.1436
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0361 0.1333
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.022 0.5971
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Toxoplasma gondii ATPase, AAA family protein 0.001 0.0048 0.0401
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0361 0.1333
Brugia malayi Animal haem peroxidase family protein 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Echinococcus granulosus slit 2 protein 0.0079 0.0906 0.1832
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0056 0.0091
Loa Loa (eye worm) beta-lactamase 0.0035 0.0361 0.0714
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0056 0.0044
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0042 0.045 0.0899
Echinococcus granulosus neural cadherin 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Conserved protein 0.0035 0.0361 0.1333
Brugia malayi Blistered cuticle protein 3 0.04 0.489 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0141 0.1674 0.1664
Brugia malayi beta-lactamase family protein 0.0035 0.0361 0.0714
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.022 0.5971
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.001 0.0048 0.1028
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.001 0.0048 0.0315
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0117 0.0105
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0012 0.0044
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.022 0.183
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.022 0.5971
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Mycobacterium ulcerans hypothetical protein 0.0024 0.022 0.5971
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0246 0.0784
Brugia malayi EGF-like domain containing protein 0.0079 0.0906 0.1832
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0056 0.0044
Echinococcus granulosus peroxidasin 0.04 0.489 1
Brugia malayi Calcium binding EGF domain containing protein 0.0079 0.0906 0.1832
Echinococcus granulosus Protein patched homolog 1 0.0042 0.045 0.0899
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0056 0.0091
Mycobacterium tuberculosis Conserved protein 0.0035 0.0361 0.1333
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0117 0.0105
Mycobacterium ulcerans lipase LipD 0.0035 0.0361 1
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0713 0.1436
Echinococcus multilocularis replication factor c subunit 1 0.001 0.0048 0.0036
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0056 0.0091
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0713 0.1436
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Echinococcus granulosus survival motor neuron protein 1 0.0167 0.1994 0.4064
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0012 0.0044
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Brugia malayi hypothetical protein 0.04 0.489 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0056 0.0091
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0117 0.3016
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0073
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0134 0.0494
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0361 0.0714
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0056 0.0044
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0117 0.1176
Onchocerca volvulus Peroxidase homolog 0.04 0.489 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0312 0.0615
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0117 0.0105
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0015 0.0117 0.4497
Onchocerca volvulus Slit protein homolog 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0031 0.0312 0.0615
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0056 0.0091
Echinococcus multilocularis peroxidasin 0.04 0.489 0.4884
Echinococcus granulosus notch 0.0079 0.0906 0.1832
Echinococcus granulosus expressed conserved protein 0.0093 0.1075 0.2178
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0117 0.0105
Mycobacterium ulcerans beta-lactamase 0.0035 0.0361 1
Onchocerca volvulus Neurogenic locus notch homolog 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0007 0.0012 0.0044
Brugia malayi isocitrate dehydrogenase 0.0015 0.0117 0.0215
Loa Loa (eye worm) hypothetical protein 0.0018 0.0146 0.0274
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0117 0.0215
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0117 0.3016
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0246 0.0479
Brugia malayi beta-lactamase 0.0035 0.0361 0.0714
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) hypothetical protein 0.0011 0.0056 0.0091
Echinococcus granulosus protein jagged 2 0.0079 0.0906 0.1832
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0361 0.1169
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0.0117 0.3016
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0056 0.0091
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0099 0.1149 1
Echinococcus multilocularis survival motor neuron protein 1 0.0167 0.1994 0.1985
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Brugia malayi AMP-binding enzyme family protein 0.0024 0.022 0.0427
Echinococcus granulosus neurogenic locus notch protein 0.0079 0.0906 0.1832
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.022 0.0814
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Onchocerca volvulus Peroxidase homolog 0.04 0.489 1
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0713 0.1436
Loa Loa (eye worm) hypothetical protein 0.04 0.489 1
Plasmodium vivax SET domain protein, putative 0.0031 0.0312 0.8612
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0117 0.3016
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0079 0.0906 0.1832
Brugia malayi Pax transcription activation domain interacting protein 0.001 0.0048 0.0073
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0312 0.3358
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Echinococcus multilocularis neural cadherin 0.0079 0.0906 0.0895
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0056 0.0091
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0134 0.0494
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0361 0.1169
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.022 0.0814
Schistosoma mansoni hypothetical protein 0.0079 0.0906 0.1832
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0056 0.0091
Loa Loa (eye worm) hypothetical protein 0.0024 0.022 0.0427
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0217 0.2621 0.5349
Echinococcus granulosus neurogenic locus protein delta 0.0079 0.0906 0.1832
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.022 0.5971
Mycobacterium tuberculosis Conserved protein 0.0035 0.0361 0.1333
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0056 0.0091
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0048 0.012
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0007 0.0012 0.0044
Schistosoma mansoni survival motor neuron protein 0.0034 0.0348 0.0688
Echinococcus multilocularis fibropellin Ia 0.0079 0.0906 0.0895
Echinococcus multilocularis fat cadherin tumor suppressor 0.0079 0.0906 0.0895
Giardia lamblia Flap structure-specific endonuclease 0.0026 0.0246 0.2306
Brugia malayi Animal haem peroxidase family protein 0.04 0.489 1
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0246 0.2615
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.022 0.5971
Brugia malayi nuclear hormone receptor 0.0011 0.0056 0.0091
Echinococcus multilocularis neurogenic locus notch protein 4 0.0079 0.0906 0.0895
Loa Loa (eye worm) hypothetical protein 0.0079 0.0906 0.1832
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0034 0.0348 0.0688

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 116 uM In vitro acyl-coenzyme A:cholesterol acyltransferase inhibition in rat liver microsomes ChEMBL. 11708931
IC50 (binding) = 116 uM In vitro acyl-coenzyme A:cholesterol acyltransferase inhibition in rat liver microsomes ChEMBL. 11708931

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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