Detailed information for compound 1395410

Basic information

Technical information
  • TDR Targets ID: 1395410
  • Name: 3-(adamantane-1-carbonylamino)-3-(4-cyclopent yloxyphenyl)propanoic acid
  • MW: 411.534 | Formula: C25H33NO4
  • H donors: 2 H acceptors: 3 LogP: 4.39 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)CC(c1ccc(cc1)OC1CCCC1)NC(=O)C12CC3CC(C2)CC(C1)C3
  • InChi: 1S/C25H33NO4/c27-23(28)12-22(19-5-7-21(8-6-19)30-20-3-1-2-4-20)26-24(29)25-13-16-9-17(14-25)11-18(10-16)15-25/h5-8,16-18,20,22H,1-4,9-15H2,(H,26,29)(H,27,28)
  • InChiKey: CKGFSJKOUFSHNS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(adamantane-1-carbonylamino)-3-[4-(cyclopentoxy)phenyl]propanoic acid
  • 3-[(1-adamantyl-oxomethyl)amino]-3-[4-(cyclopentoxy)phenyl]propanoic acid
  • 3-(adamantane-1-carbonylamino)-3-[4-(cyclopentoxy)phenyl]propionic acid
  • 3-(1-adamantylcarbonylamino)-3-(4-cyclopentyloxyphenyl)propanoic acid
  • MLS000675008
  • SMR000313611
  • A3417/0144987
  • 3-[(1-adamantylcarbonyl)amino]-3-[4-(cyclopentyloxy)phenyl]propanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
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
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0034 0.0218 0.098
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0211 0.03
Echinococcus granulosus thyroid hormone receptor alpha 0.0034 0.0218 0.0658
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0043 0.0326 0.0984
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0073 0.069 0.3102
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0038 0.0268 0.0608
Echinococcus multilocularis netrin receptor unc 5 0.0043 0.0326 0.0984
Loa Loa (eye worm) hypothetical protein 0.0286 0.3312 0.472
Brugia malayi tailless protein 0.0034 0.0218 0.0311
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0353 0.0503
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Echinococcus granulosus Ankyrin 0.0043 0.033 0.0997
Schistosoma mansoni ankyrin 23/unc44 0.0043 0.0326 0.0738
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0043 0.0326 0.0464
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0073 0.069 0.2084
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0161 0.1781 0.2539
Echinococcus granulosus jun protein 0.0251 0.2889 0.8723
Onchocerca volvulus 0.0034 0.0218 0.098
Schistosoma mansoni jun-related protein 0.0204 0.2309 0.5232
Schistosoma mansoni retinoic acid receptor RXR 0.017 0.1889 0.4279
Echinococcus granulosus single minded 2 0.0036 0.0234 0.0707
Loa Loa (eye worm) hypothetical protein 0.0038 0.0268 0.0383
Entamoeba histolytica cysteine proteinase, putative 0.0017 0 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0251 0.2889 0.8723
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0073 0.069 0.2084
Echinococcus multilocularis transfer RNA-Lys 0.0036 0.0234 0.0707
Brugia malayi Nuclear hormone receptor E75 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypothetical protein 0.0587 0.7017 1
Echinococcus granulosus FTZ F1 alpha 0.0073 0.069 0.2084
Brugia malayi ecdysteroid receptor 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0034 0.0211 0.03
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0043 0.033 0.0748
Brugia malayi conserved hypotetical protein 0.0034 0.0218 0.0311
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0017 0 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Schistosoma mansoni nuclear receptor 0.0034 0.0218 0.0494
Brugia malayi nuclear receptor NHR-67 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0038 0.0268 0.0383
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0132 0.1417 0.4279
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0403 0.0574
Brugia malayi nuclear receptor NHR-88 0.0034 0.0218 0.0311
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0353 0.1065
Schistosoma mansoni hypothetical protein 0.0034 0.0211 0.0478
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0073 0.069 0.2084
Echinococcus multilocularis thyroid hormone receptor alpha 0.0073 0.069 0.2084
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Echinococcus multilocularis FTZ F1 alpha 0.0073 0.069 0.2084
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0073 0.069 0.0983
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Echinococcus granulosus Nuclear hormone receptor HR96 0.0034 0.0218 0.0658
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0038 0.0268 0.0811
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0038 0.0268 0.0608
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0073 0.069 0.0983
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0038 0.0268 0.0383
Loa Loa (eye worm) hypothetical protein 0.0244 0.2804 0.3996
Schistosoma mansoni hypothetical protein 0.0043 0.0326 0.0738
Toxoplasma gondii cathepsin CPL 0.0017 0 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0038 0.0268 0.0383
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0073 0.069 0.0983
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Echinococcus granulosus netrin receptor unc 5 0.0043 0.0326 0.0984
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Brugia malayi orphan nuclear receptor NR2E1 0.0034 0.0218 0.0311
Schistosoma mansoni thyroid hormone receptor 0.0073 0.069 0.1563
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Brugia malayi hypoxia-induced factor 1 0.0149 0.1628 0.232
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Onchocerca volvulus 0.0034 0.0218 0.098
Schistosoma mansoni single-minded 0.0048 0.0388 0.0879
Schistosoma mansoni survival motor neuron protein 0.0058 0.0513 0.1163
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.3312 1
Mycobacterium ulcerans proteasome PrcA 0.0829 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Schistosoma mansoni nuclear hormone receptor 0.0073 0.069 0.1563
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Brugia malayi nuclear receptor RXR 0.0038 0.0268 0.0383
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0034 0.0218 0.0311
Schistosoma mansoni zinc finger protein 0.0034 0.0218 0.0494
Brugia malayi Nuclear hormone receptor-like 1 0.0073 0.069 0.0983
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0073 0.069 0.2084
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0038 0.0268 0.0811
Loa Loa (eye worm) hypothetical protein 0.0038 0.0268 0.0383
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0073 0.069 0.2084
Brugia malayi hypothetical protein 0.0034 0.0218 0.0311
Plasmodium vivax vivapain-2 0.0017 0 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0251 0.2889 0.8723
Onchocerca volvulus 0.0036 0.0234 0.1053
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Brugia malayi bZIP transcription factor family protein 0.0251 0.2889 0.4117
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0034 0.0218 0.0658
Brugia malayi photoreceptor-specific nuclear receptor 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0038 0.0268 0.0383
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0073 0.069 0.0983
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0073 0.069 0.0983
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.033 0.0471
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0073 0.069 0.1563
Loa Loa (eye worm) hypothetical protein 0.0038 0.0268 0.0383
Brugia malayi hypothetical protein 0.0034 0.0218 0.0311
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0073 0.069 0.2084
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0017 0 0.5
Onchocerca volvulus 0.0073 0.069 0.3102
Brugia malayi Nuclear hormone receptor E75 0.0034 0.0218 0.0311
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Brugia malayi Uncoordinated protein 44 0.0043 0.0326 0.0464
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0043 0.0326 0.0464
Onchocerca volvulus 0.0058 0.0513 0.2307
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0058 0.0505 0.8824
Plasmodium falciparum cysteine proteinase falcipain 3 0.0017 0 0.5
Mycobacterium tuberculosis Proteasome alpha subunit PrcA; assembles with beta subunit PrcB. 0.0829 1 0.5
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.0572 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.0218 0.0658
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0017 0 0.5
Onchocerca volvulus 0.0197 0.2225 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0403 0.0574
Brugia malayi hypothetical protein 0.0038 0.0268 0.0383
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0073 0.069 0.0983
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0073 0.069 0.0983
Plasmodium vivax vivapain-2 0.0017 0 0.5
Schistosoma mansoni nuclear hormone receptor 0.0034 0.0218 0.0494
Echinococcus granulosus death domain containing protein 0.0043 0.0326 0.0984
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0353 0.0503
Brugia malayi nuclear receptor RXR 0.0034 0.0218 0.0311
Brugia malayi hypothetical protein 0.0286 0.3312 0.472
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0353 0.0799
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0353 0.1065
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Brugia malayi nuclear hormone receptor 0.0073 0.069 0.0983
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0073 0.069 0.0983
Schistosoma mansoni netrin receptor unc5 0.0043 0.0326 0.0738
Echinococcus multilocularis jun protein 0.0251 0.2889 0.8723
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0073 0.069 0.0983
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Entamoeba histolytica cysteine proteinase, putative 0.0017 0 0.5
Echinococcus multilocularis Ankyrin 0.0043 0.033 0.0997
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0073 0.069 0.0983
Echinococcus multilocularis ecdysone induced protein 78C 0.0073 0.069 0.2084
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0513 0.0732
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1571 0.2239
Loa Loa (eye worm) nuclear hormone receptor 0.0034 0.0218 0.0311
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0353 0.0799
Brugia malayi nuclear hormone receptor 0.0034 0.0218 0.0311
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0073 0.069 0.0983
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Schistosoma mansoni nuclear hormone receptor 0.0034 0.0218 0.0494
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Brugia malayi nuclear hormone receptor family member nhr-6 0.0034 0.0218 0.0311
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0073 0.069 0.2084
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0073 0.069 0.2084
Brugia malayi Cytochrome P450 family protein 0.0045 0.0347 0.0494
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0073 0.069 0.0983
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0034 0.0218 0.098
Onchocerca volvulus Protein ultraspiracle homolog 0.0073 0.069 0.3102
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0073 0.069 0.1563
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0073 0.069 0.0983
Schistosoma mansoni RAR-like nuclear receptor 0.0073 0.069 0.1563
Schistosoma mansoni hypothetical protein 0.0058 0.0513 0.1163
Schistosoma mansoni nuclear receptor 0.0034 0.0218 0.0494
Schistosoma mansoni coup transcription factor 0.0073 0.069 0.1563
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0353 0.1065
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0073 0.069 0.0983
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0073 0.069 0.1563
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0073 0.069 0.0983
Brugia malayi PAS domain containing protein 0.0048 0.0388 0.0553
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0073 0.069 0.2084
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Brugia malayi hypothetical protein 0.0197 0.2225 0.3171
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0403 0.0574
Entamoeba histolytica cysteine protease, putative 0.0017 0 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0353 0.1065
Echinococcus granulosus retinoic acid receptor rxr beta a 0.017 0.1889 0.5705
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0403 0.0574
Brugia malayi Protein kinase domain containing protein 0.0043 0.0326 0.0464
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Brugia malayi nuclear receptor NHR-88 0.0073 0.069 0.0983
Brugia malayi hypothetical protein 0.0161 0.1781 0.2539
Schistosoma mansoni nuclear receptor nhr-48 0.0034 0.0218 0.0494
Echinococcus multilocularis nuclear factor of activated T cells 5 0.022 0.2508 0.7574
Brugia malayi small heat shock protein 0.0587 0.7017 1
Schistosoma mansoni thyroid hormone receptor 0.0073 0.069 0.1563
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0073 0.069 0.1563
Brugia malayi Steroid receptor seven-up type 2 0.0073 0.069 0.0983
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Brugia malayi ecdysone receptor 0.0034 0.0218 0.0311
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0353 0.0799
Trypanosoma cruzi major cysteine proteinase, putative 0.005 0.0406 0.7098
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1571 0.2239
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Schistosoma mansoni steroid hormone receptor ad4bp 0.0073 0.069 0.1563
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0017 0 0.5
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.3312 1
Echinococcus granulosus nuclear factor of activated T cells 5 0.022 0.2508 0.7574
Echinococcus granulosus ecdysone induced protein 78C 0.0073 0.069 0.2084
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0073 0.069 0.2084
Loa Loa (eye worm) nuclear receptor NHR-67 0.0034 0.0218 0.0311
Loa Loa (eye worm) hypoxia-induced factor 1 0.0149 0.1628 0.232
Brugia malayi Nuclear hormone receptor-like 1 0.0038 0.0268 0.0383
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0073 0.069 0.0983
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0073 0.069 0.1563
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.0218 0.0658
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0073 0.069 0.2084
Loa Loa (eye worm) hypothetical protein 0.0034 0.0218 0.0311
Brugia malayi MH2 domain containing protein 0.0144 0.1571 0.2239
Echinococcus granulosus nuclear receptor nhr 48 0.0034 0.0218 0.0658
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0073 0.069 0.2084
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0073 0.069 0.0983
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Echinococcus multilocularis nuclear receptor nhr 48 0.0034 0.0218 0.0658
Onchocerca volvulus Bile acid receptor homolog 0.0073 0.069 0.3102
Loa Loa (eye worm) steroid hormone receptor 0.0073 0.069 0.0983
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0034 0.0218 0.0658
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0034 0.0218 0.0494
Brugia malayi hypothetical protein 0.0038 0.0268 0.0383
Brugia malayi Death domain containing protein 0.0043 0.0326 0.0464
Loa Loa (eye worm) cytochrome P450 family protein 0.0045 0.0347 0.0494
Onchocerca volvulus Netrin receptor homolog 0.0043 0.0326 0.1464
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0 0.5
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0034 0.0218 0.0311
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0073 0.069 0.1563
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0326 0.0464
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Brugia malayi nuclear hormone receptor family member odr-7 0.0034 0.0218 0.0311
Echinococcus granulosus Nuclear hormone receptor HR96 0.0034 0.0218 0.0658
Schistosoma mansoni hypothetical protein 0.0204 0.2309 0.5232
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0043 0.0326 0.0984
Schistosoma mansoni aryl hydrocarbon receptor 0.0048 0.0388 0.0879
Brugia malayi steroid hormone receptor 0.0073 0.069 0.0983
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0073 0.069 0.0983
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0034 0.0218 0.0658
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0073 0.069 0.0983
Brugia malayi bHLH-PAS transcription factor 0.0036 0.0234 0.0334
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0 0.5
Loa Loa (eye worm) DR-78 0.0034 0.0218 0.0311
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0034 0.0218 0.0658
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0375 0.4414 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.004 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 33.8078 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference

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

No literature references available for this target.

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