Detailed information for compound 1069420

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 421.575 | Formula: C26H35N3O2
  • H donors: 0 H acceptors: 2 LogP: 4.24 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(COc1ccccc1CN1CCC2(CC1)CCN(CC2)C(=O)c1ccncc1)C
  • InChi: 1S/C26H35N3O2/c1-21(2)20-31-24-6-4-3-5-23(24)19-28-15-9-26(10-16-28)11-17-29(18-12-26)25(30)22-7-13-27-14-8-22/h3-8,13-14,21H,9-12,15-20H2,1-2H3
  • InChiKey: GLKFHODDQQHCAX-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens potassium voltage-gated channel, subfamily H (eag-related), member 2 Starlite/ChEMBL References
Homo sapiens chemokine (C-C motif) receptor 8 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog Get druggable targets OG5_128858 All targets in OG5_128858
Echinococcus multilocularis potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Loa Loa (eye worm) voltage and ligand gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Echinococcus granulosus potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum Potassium voltage-gated channel subfamily H member 2, putative Get druggable targets OG5_128858 All targets in OG5_128858

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
Loa Loa (eye worm) hypothetical protein 0.0034 0.0156 0.0266
Loa Loa (eye worm) hypothetical protein 0.0083 0.0468 0.0799
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0014 0.0031 0.0546
Schistosoma mansoni hypothetical protein 0.001 0.0007 0.0016
Echinococcus multilocularis cyclic AMP responsive element binding protein 0.001 0.0007 0.0007
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0334 0.057
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0047 0.0238 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0042 0.0042
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Schistosoma mansoni hypothetical protein 0.0016 0.0042 0.01
Loa Loa (eye worm) hypothetical protein 0.0039 0.0188 0.0321
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.007 0.007
Schistosoma mansoni nuclear receptor 0.0009 0.0004 0.0008
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus granulosus death domain containing protein 0.0062 0.0334 0.0789
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0254 0.0433
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0062 0.0334 0.057
Brugia malayi CHE-14 protein 0.0083 0.0468 0.0799
Loa Loa (eye worm) hypothetical protein 0.0035 0.0164 0.028
Onchocerca volvulus Protein patched homolog 0.0012 0.0018 0.0025
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0152 0.6071
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0062 0.0334 0.0334
Trypanosoma brucei transcription factor BTF3, putative 0.0034 0.0162 0.1059
Schistosoma mansoni hypothetical protein 0.0016 0.0042 0.01
Brugia malayi Niemann-Pick C1 protein precursor 0.0194 0.1165 0.1988
Mycobacterium ulcerans hypothetical protein 0.0024 0.0097 0.3171
Schistosoma mansoni camp-response element binding protein-related 0.001 0.0007 0.0016
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0009 0.0004 0.0008
Brugia malayi hypothetical protein 0.0009 0.0004 0.0006
Onchocerca volvulus 0.0014 0.0031 0.0046
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0013 0.0026 0.0061
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0031 0.0657
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.0251 0.0593
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0014 0.0031 0.0546
Echinococcus multilocularis citrate lyase subunit beta protein 0.0024 0.0097 0.0097
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Brugia malayi bZIP transcription factor family protein 0.001 0.0007 0.0012
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.007 0.0165
Echinococcus granulosus cyclic AMP dependent transcription factor ATF 6 0.001 0.0007 0.0016
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0018
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0047 0.0238 1
Echinococcus multilocularis cAMP responsive element binding protein 3 0.001 0.0007 0.0007
Brugia malayi Myosin head containing protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0018
Echinococcus multilocularis sterol regulatory element binding protein 0.0083 0.0468 0.0468
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0047 0.0238 0.0407
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0031 0.0546
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Mycobacterium ulcerans hypothetical protein 0.0047 0.0238 1
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.007 0.0119
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Brugia malayi Uncoordinated protein 44 0.0062 0.0334 0.057
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0047 0.0238 1
Entamoeba histolytica hypothetical protein 0.0034 0.0162 0.1153
Onchocerca volvulus 0.0012 0.0018 0.0025
Schistosoma mansoni transcription factor btf3 0.0034 0.0162 0.0382
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0009 0.0004 0.0006
Loa Loa (eye worm) nuclear receptor NHR-67 0.0009 0.0004 0.0006
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.007 0.0119
Brugia malayi nuclear receptor RXR 0.0011 0.0011 0.0018
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus granulosus geminin 0.0167 0.0997 0.2356
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.002 0.007 0.0113
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0162 0.345
Brugia malayi protein C24B5.3 0.0012 0.0018 0.0031
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0194 0.1165 1
Brugia malayi bZIP transcription factor family protein 0.001 0.0007 0.0012
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.007 0.0119
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.007 0.0165
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.007 0.0119
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.007 0.0119
Echinococcus granulosus expressed conserved protein 0.0182 0.1091 0.2579
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0156 0.0266
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi Patched protein homolog 1 0.0012 0.0018 0.0031
Echinococcus multilocularis Niemann Pick C1 protein 0.0194 0.1165 0.1165
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0238 0.0407
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.0512 0.0873
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0162 0.345
Schistosoma mansoni nuclear hormone receptor 0.0009 0.0004 0.0008
Leishmania major basic transcription factor 3a, putative 0.0034 0.0162 0.1059
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0062 0.0334 0.0789
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0014 0.0031 0.0546
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus granulosus nuclear receptor nhr 48 0.0009 0.0004 0.0008
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0238 1
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0024 0.0097 0.3171
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0024 0.0097 0.0533
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0011 0.0025
Echinococcus multilocularis nuclear receptor nhr 48 0.0009 0.0004 0.0004
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.007 0.0119
Loa Loa (eye worm) hypothetical protein 0.0035 0.0164 0.028
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.001 0.0007 0.0012
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0011 0.0018
Loa Loa (eye worm) hypothetical protein 0.0047 0.0238 0.0407
Schistosoma mansoni hypothetical protein 0.0167 0.0997 0.2356
Trypanosoma cruzi hypothetical protein, conserved 0.021 0.1266 1
Schistosoma mansoni netrin receptor unc5 0.0062 0.0334 0.0789
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0238 0.1682
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0009 0.0004 0.0004
Brugia malayi hypothetical protein 0.0232 0.1408 0.2401
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0062 0.0337 0.0797
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0026 0.0061
Schistosoma mansoni hypothetical protein 0.0071 0.0391 0.0923
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi beta-NAC-like protein 0.0034 0.0162 0.0276
Brugia malayi nuclear hormone receptor 0.002 0.007 0.0119
Plasmodium falciparum acyl-CoA synthetase 0.0035 0.0164 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.007 0.0119
Schistosoma mansoni hypothetical protein 0.0016 0.0042 0.01
Plasmodium vivax acetyl-CoA synthetase, putative 0.0014 0.0031 0.0844
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.007 0.0119
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.007 0.0119
Onchocerca volvulus 0.0939 0.5863 1
Schistosoma mansoni nuclear receptor nhr-48 0.0009 0.0004 0.0008
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus granulosus cyclic AMP responsive element binding protein 0.001 0.0007 0.0016
Loa Loa (eye worm) hypothetical protein 0.0035 0.0164 0.028
Echinococcus granulosus GPCR family 2 0.0016 0.0042 0.01
Schistosoma mansoni hypothetical protein 0.008 0.0449 0.1062
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.001 0.0007 0.0016
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0045 0.0225 0.0384
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni camp-response element binding protein 0.001 0.0007 0.0016
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0031 0.0546
Entamoeba histolytica acyl-coA synthetase, putative 0.0047 0.0238 0.183
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0014 0.0031 0.0546
Entamoeba histolytica hypothetical protein 0.0071 0.0391 0.3171
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.007 0.0165
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.007 0.0165
Schistosoma mansoni hypothetical protein 0.0047 0.0243 0.0574
Leishmania major hypothetical protein, conserved 0.021 0.1266 1
Brugia malayi hypothetical protein 0.001 0.0007 0.0012
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.007 0.0165
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Echinococcus granulosus jun protein 0.001 0.0007 0.0016
Loa Loa (eye worm) bZIP transcription factor family protein 0.001 0.0007 0.0012
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0047 0.0238 1
Onchocerca volvulus 0.0012 0.0018 0.0025
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0047 0.0238 1
Trypanosoma brucei hypothetical protein, conserved 0.021 0.1266 1
Brugia malayi Steroid receptor seven-up type 2 0.002 0.007 0.0119
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.007 0.0165
Brugia malayi steroid hormone receptor 0.002 0.007 0.0119
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni hypothetical protein 0.0016 0.0042 0.01
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Trypanosoma cruzi hypothetical protein, conserved 0.021 0.1266 1
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Echinococcus granulosus Protein patched homolog 1 0.0083 0.0468 0.1107
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Brugia malayi hypothetical protein 0.0012 0.0018 0.0031
Echinococcus granulosus FTZ F1 alpha 0.002 0.007 0.0165
Echinococcus multilocularis FTZ F1 alpha 0.002 0.007 0.007
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0009 0.0004 0.0006
Brugia malayi nuclear receptor NHR-88 0.002 0.007 0.0119
Loa Loa (eye worm) hypothetical protein 0.0014 0.0031 0.0052
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0018
Schistosoma mansoni zinc finger protein 0.0009 0.0004 0.0008
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0254 0.0433
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.007 0.007
Onchocerca volvulus 0.0012 0.0018 0.0025
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0238 1
Brugia malayi hypothetical protein 0.0071 0.0391 0.0666
Loa Loa (eye worm) hypothetical protein 0.0102 0.0586 0.1
Schistosoma mansoni camp-response element binding protein-related 0.001 0.0007 0.0016
Echinococcus multilocularis cyclic AMP dependent transcription factor ATF 6 0.001 0.0007 0.0007
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0014 0.0031 0.0031
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0011 0.0018
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0013 0.0026 0.0044
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.007 0.0119
Schistosoma mansoni hypothetical protein 0.0167 0.0997 0.2356
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.007 0.0165
Schistosoma mansoni nuclear hormone receptor 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Brugia malayi bZIP transcription factor family protein 0.001 0.0007 0.0012
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Echinococcus granulosus microtubule associated protein 2 0.068 0.4231 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni fos transcription factor-related 0.001 0.0007 0.0016
Plasmodium falciparum acetyl-CoA synthetase, putative 0.0014 0.0031 0.0844
Echinococcus multilocularis Ankyrin 0.0062 0.0337 0.0337
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0045 0.0225 0.0225
Echinococcus granulosus Ankyrin 0.0062 0.0337 0.0797
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0162 0.1059
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Onchocerca volvulus 0.0014 0.0031 0.0046
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi nuclear receptor NHR-67 0.0009 0.0004 0.0006
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0045 0.0225 0.0384
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.0512 0.0873
Schistosoma mansoni hypothetical protein 0.008 0.0449 0.1062
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.007 0.0119
Echinococcus granulosus Niemann Pick C1 protein 0.0277 0.1689 0.3993
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.007 0.0119
Brugia malayi nuclear receptor RXR 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0238 0.1682
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0009 0.0004 0.0008
Plasmodium vivax basic transcription factor 3b, putative 0.0034 0.0162 0.9828
Loa Loa (eye worm) nuclear hormone receptor 0.0009 0.0004 0.0006
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0238 0.1682
Echinococcus granulosus netrin receptor unc 5 0.0062 0.0334 0.0789
Loa Loa (eye worm) hypothetical protein 0.0049 0.0254 0.0433
Echinococcus multilocularis geminin 0.0167 0.0997 0.0997
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0011 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0016 0.0042 0.0072
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.0686 0.117
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0238 1
Loa Loa (eye worm) patched family protein 0.0012 0.0018 0.0031
Onchocerca volvulus 0.0012 0.0018 0.0025
Loa Loa (eye worm) ICD-1 protein 0.0034 0.0162 0.0276
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Onchocerca volvulus 0.0012 0.0018 0.0025
Toxoplasma gondii NAC domain-containing protein 0.0034 0.0162 1
Trichomonas vaginalis conserved hypothetical protein 0.0083 0.0468 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0035 0.0164 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0071 0.0391 0.0391
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0035 0.0164 0.6617
Plasmodium vivax acyl-CoA synthetase, putative 0.0035 0.0164 1
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0024 0.0097 0.3171
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.007 0.007
Brugia malayi Nuclear hormone receptor E75 0.0009 0.0004 0.0006
Echinococcus granulosus sterol regulatory element binding protein 0.0083 0.0468 0.1107
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.007 0.007
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0042 0.0042
Schistosoma mansoni patched 1 0.0083 0.0468 0.1107
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0018
Echinococcus granulosus fos transcription factor 0.001 0.0007 0.0016
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0512 0.1209
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0047 0.0238 1
Loa Loa (eye worm) patched family protein 0.0012 0.0018 0.0031
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.0251 0.0593
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0162 0.1059
Brugia malayi nuclear hormone receptor 0.0009 0.0004 0.0006
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0011 0.0011 0.0025
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.0207 0.4416
Schistosoma mansoni thyroid hormone receptor 0.002 0.007 0.0165
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.001 0.0007 0.0007
Loa Loa (eye worm) hypothetical protein 0.0062 0.0334 0.057
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0014 0.0031 0.0546
Brugia malayi cyclic AMP-response element binding protein 1 gamma 1, putative 0.0939 0.5863 1
Brugia malayi nuclear hormone receptor family member nhr-6 0.0009 0.0004 0.0006
Mycobacterium tuberculosis Probable citrate (pro-3S)-lyase (beta subunit) CitE (citrase) (citratase) (citritase) (citridesmolase) (citrase aldolase) 0.0024 0.0097 0.3544
Loa Loa (eye worm) hypothetical protein 0.0194 0.1165 0.1988
Loa Loa (eye worm) hypothetical protein 0.0062 0.0337 0.0575
Loa Loa (eye worm) hypothetical protein 0.0035 0.0164 0.028
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.007 0.0119
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0024 0.0097 0.0533
Echinococcus multilocularis voltage gated potassium channel 0.0013 0.0026 0.0026
Loa Loa (eye worm) bZIP transcription factor family protein 0.001 0.0007 0.0012
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0011 0.0011 0.0025
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.007 0.0119
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni microtubule-associated protein tau 0.068 0.4231 1
Brugia malayi hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0083 0.0468 0.0799
Brugia malayi tailless protein 0.0009 0.0004 0.0006
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0035 0.0164 0.6421
Schistosoma mansoni camp-response element binding protein-related 0.001 0.0007 0.0016
Schistosoma mansoni hypothetical protein 0.008 0.0449 0.1062
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.007 0.0119
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0014 0.0031 0.0073
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0013 0.0026 0.0044
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0316 0.194 0.194
Brugia malayi hypothetical protein 0.0011 0.0011 0.0018
Brugia malayi bZIP transcription factor family protein 0.001 0.0007 0.0012
Plasmodium falciparum basic transcription factor 3b, putative 0.0034 0.0162 0.9828
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.007 0.0119
Echinococcus multilocularis fos transcription factor 0.001 0.0007 0.0007
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi acetyl-Coenzyme A synthetase 2 0.0014 0.0031 0.0052
Onchocerca volvulus 0.0012 0.0018 0.0025
Echinococcus multilocularis microtubule associated protein 2 0.068 0.4231 0.4231
Echinococcus multilocularis expressed conserved protein 0.0182 0.1091 0.1091
Onchocerca volvulus Netrin receptor homolog 0.0062 0.0334 0.0564
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.007 0.0165
Echinococcus granulosus nuclear factor of activated T cells 5 0.0316 0.194 0.4585
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0152 0.6071
Toxoplasma gondii propionate-CoA ligase 0.0014 0.0031 0.0858
Brugia malayi hypothetical protein 0.0012 0.0018 0.0031
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0013 0.0026 0.0026
Echinococcus granulosus cyclic AMP responsive element binding protein 0.001 0.0007 0.0016
Onchocerca volvulus 0.0047 0.0238 0.0401
Brugia malayi nuclear hormone receptor family member odr-7 0.0009 0.0004 0.0006
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0512 0.1209
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni ankyrin 23/unc44 0.0062 0.0334 0.0789
Echinococcus granulosus cAMP responsive element binding protein 3 0.001 0.0007 0.0016
Loa Loa (eye worm) oxidoreductase 0.0014 0.0031 0.0052
Echinococcus granulosus citrate lyase subunit beta protein 0.0024 0.0097 0.0228
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.007 0.0119
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.007 0.0165
Loa Loa (eye worm) bZIP transcription factor family protein 0.001 0.0007 0.0012
Brugia malayi MH2 domain containing protein 0.0118 0.0686 0.117
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi hypothetical protein 0.0011 0.0011 0.0018
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0512 0.0512
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.007 0.007
Echinococcus multilocularis Niemann Pick C1 protein 0.0277 0.1689 0.1689
Brugia malayi hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0238 0.0407
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0512 0.1209
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0238 0.0407
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0014 0.0031 0.0546
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.007 0.0119
Brugia malayi Patched related family protein 4 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0238 0.183
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0014 0.0031 0.0546
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0238 0.183
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0042 0.01
Echinococcus multilocularis expressed protein 0.001 0.0007 0.0007
Onchocerca volvulus 0.0014 0.0031 0.0046
Echinococcus granulosus Niemann Pick C1 protein 0.0194 0.1165 0.2754
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.1408 0.3328
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0152 0.6071
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0512 0.0512
Brugia malayi Patched related family protein 12 0.0012 0.0018 0.0031
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.001 0.0007 0.0016
Onchocerca volvulus 0.0012 0.0018 0.0025
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.007 0.0165
Onchocerca volvulus Bile acid receptor homolog 0.002 0.007 0.0113
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0009 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0047 0.0238 0.0407
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.007 0.0119
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0152 0.6071
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.007 0.0165
Schistosoma mansoni hypothetical protein 0.001 0.0007 0.0016
Echinococcus granulosus Nuclear hormone receptor HR96 0.0009 0.0004 0.0008
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0197 0.1184 0.2799
Onchocerca volvulus Protein patched homolog 0.0012 0.0018 0.0025
Schistosoma mansoni hypothetical protein 0.0034 0.0156 0.0369
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Onchocerca volvulus 0.002 0.007 0.0113
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Brugia malayi Patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0018
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0042 0.01
Onchocerca volvulus 0.0014 0.0031 0.0046
Toxoplasma gondii Acetyl-coenzyme A synthetase 2, putative 0.0014 0.0031 0.0858
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.007 0.0165
Brugia malayi Patched related family protein 10 0.0012 0.0018 0.0031
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0162 0.345
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0243 0.0414
Brugia malayi orphan nuclear receptor NR2E1 0.0009 0.0004 0.0006
Brugia malayi ecdysone receptor 0.0009 0.0004 0.0006
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.001 0.0007 0.0007
Brugia malayi Protein kinase domain containing protein 0.0062 0.0334 0.057
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0009 0.0004 0.0008
Loa Loa (eye worm) DR-78 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.007 0.0119
Schistosoma mansoni thyroid hormone receptor 0.002 0.007 0.0165
Mycobacterium ulcerans citrate lyase beta subunit, CitE_2 0.0024 0.0097 0.3171
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.007 0.0165
Echinococcus granulosus Nuclear hormone receptor HR96 0.0009 0.0004 0.0008
Onchocerca volvulus 0.0047 0.0243 0.0409
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.0686 0.117
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.0207 0.4416
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0042 0.0072
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0009 0.0004 0.0008
Brugia malayi Death domain containing protein 0.0062 0.0334 0.057
Entamoeba histolytica hypothetical protein 0.0071 0.0391 0.3171
Brugia malayi Nuclear hormone receptor E75 0.0009 0.0004 0.0006
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.007 0.007
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0009 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0009 0.0004 0.0004
Leishmania major 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0024 0.0097 0.0533
Echinococcus granulosus expressed protein 0.001 0.0007 0.0016
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0026 0.0061
Loa Loa (eye worm) patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0011 0.0011 0.0018
Schistosoma mansoni jun-related protein 0.001 0.0007 0.0016
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0031 0.0546
Trichomonas vaginalis Citrate lyase beta chain, putative 0.0024 0.0097 0.2063
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Schistosoma mansoni hypothetical protein 0.008 0.0449 0.1062
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0238 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0045 0.0225 0.0532
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.1408 0.1408
Echinococcus granulosus transcription factor btf3 0.0034 0.0162 0.0382
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0238 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.007 0.0119
Mycobacterium tuberculosis Conserved protein 0.0024 0.0097 0.3544
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.007 0.007
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Onchocerca volvulus 0.001 0.0007 0.0006
Schistosoma mansoni survival motor neuron protein 0.0047 0.0243 0.0574
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0031 0.0657
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0071 0.0391 0.0923
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0031 0.0546
Loa Loa (eye worm) patched family protein 0.0012 0.0018 0.0031
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0042 0.0072
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Echinococcus multilocularis GPCR, family 2 0.0016 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Loa Loa (eye worm) hypothetical protein 0.0035 0.0164 0.028
Entamoeba histolytica hypothetical protein 0.0071 0.0391 0.3171
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0512 0.1209
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0014 0.0031 0.0052
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.007 0.007
Echinococcus multilocularis protein patched 0.0083 0.0468 0.0468
Echinococcus granulosus voltage gated potassium channel 0.0013 0.0026 0.0061
Loa Loa (eye worm) steroid hormone receptor 0.002 0.007 0.0119
Echinococcus multilocularis protein dispatched 1 0.0095 0.0542 0.0542
Loa Loa (eye worm) hypothetical protein 0.0232 0.1408 0.2401
Schistosoma mansoni nuclear hormone receptor 0.0009 0.0004 0.0008
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Mycobacterium ulcerans hypothetical protein 0.0024 0.0097 0.3171
Echinococcus multilocularis jun protein 0.001 0.0007 0.0007
Brugia malayi bZIP transcription factor family protein 0.001 0.0007 0.0012
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0254 0.0433
Schistosoma mansoni acetyl-CoA synthetase 0.0014 0.0031 0.0073
Schistosoma mansoni hypothetical protein 0.0062 0.0334 0.0789
Schistosoma mansoni coup transcription factor 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Entamoeba histolytica hypothetical protein 0.0071 0.0391 0.3171
Brugia malayi nuclear receptor NHR-88 0.0009 0.0004 0.0006
Brugia malayi hypothetical protein 0.0009 0.0004 0.0006
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0014 0.0031 0.0858
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0009 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Onchocerca volvulus Protein ultraspiracle homolog 0.002 0.007 0.0113
Loa Loa (eye worm) hypothetical protein 0.002 0.007 0.0119
Brugia malayi protein C24B5.3 0.0012 0.0018 0.0031
Schistosoma mansoni transcription factor LCR-F1 0.0071 0.0391 0.0923
Echinococcus granulosus thyroid hormone receptor alpha 0.0009 0.0004 0.0008
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0042 0.0072
Entamoeba histolytica transcription factor BTF3, putative 0.0034 0.0162 0.1153
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.007 0.0165
Loa Loa (eye worm) hypothetical protein 0.0939 0.5863 1
Echinococcus multilocularis transcription factor btf3 0.0034 0.0162 0.0162
Loa Loa (eye worm) hypothetical protein 0.001 0.0007 0.0012
Brugia malayi conserved hypotetical protein 0.0009 0.0004 0.0006
Brugia malayi ecdysteroid receptor 0.002 0.007 0.0119
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.007 0.0119
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0512 0.1209
Loa Loa (eye worm) patched family protein 0.0012 0.0018 0.0031
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0031
Echinococcus multilocularis netrin receptor unc 5 0.0062 0.0334 0.0334
Loa Loa (eye worm) hypothetical protein 0.0014 0.0031 0.0052
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0031 0.0052
Schistosoma mansoni nuclear receptor 0.0009 0.0004 0.0008

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 4.82 Displacement of [3H]dofetilide from human recombinant ERG expressed in HEK293 cells by patch clamp method ChEMBL. 19954248
IC50 (binding) = 5.72 Inhibition of wild type human ERG expressed in CHOK1 cells by whole-cell plate-based electrophysiology ChEMBL. 19954248
IC50 (functional) = 6.97 Antagonist activity at human CCR8 ChEMBL. 19954248

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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