Detailed information for compound 80636

Basic information

Technical information
  • TDR Targets ID: 80636
  • Name: benzyl (2S)-1-(2,2-dimethylpropylcarbamoyl)pi peridine-2-carboxylate
  • MW: 332.437 | Formula: C19H28N2O3
  • H donors: 1 H acceptors: 2 LogP: 3.57 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C([C@@H]1CCCCN1C(=O)NCC(C)(C)C)OCc1ccccc1
  • InChi: 1S/C19H28N2O3/c1-19(2,3)14-20-18(23)21-12-8-7-11-16(21)17(22)24-13-15-9-5-4-6-10-15/h4-6,9-10,16H,7-8,11-14H2,1-3H3,(H,20,23)/t16-/m0/s1
  • InChiKey: YIWSWQUATDBTQO-INIZCTEOSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2S)-1-[(2,2-dimethylpropylamino)-oxomethyl]-2-piperidinecarboxylic acid benzyl ester
  • phenylmethyl (2S)-1-(2,2-dimethylpropylcarbamoyl)piperidine-2-carboxylate
  • (2S)-1-(neopentylcarbamoyl)pipecolin benzyl ester
  • (2S)-1-[(2,2-dimethylpropylamino)-oxomethyl]-2-piperidinecarboxylic acid phenylmethyl ester
  • (2S)-1-(neopentylcarbamoyl)pipecolinic acid benzyl ester

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens FK506 binding protein 1A, 12kDa Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei gambiense peptidylprolyl isomerase-like protein, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Theileria parva peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis immunophilin, putative Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans hypothetical protein Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis fk506 binding protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania mexicana fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania donovani peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma congolense peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania major peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania infantum fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Neospora caninum Peptidylprolyl isomerase D (Cyclophilin D), related Get druggable targets OG5_126727 All targets in OG5_126727
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis fk506-binding protein, putative Get druggable targets OG5_126727 All targets in OG5_126727
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) FKBP5 protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania donovani fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania major fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania mexicana peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma japonicum ko:K09571 FK506-binding protein 4/5, putative Get druggable targets OG5_126727 All targets in OG5_126727
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium berghei peptidyl-prolyl cis-trans isomerase FKBP35, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania braziliensis peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium yoelii FK506-binding protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei gambiense peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania braziliensis fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma congolense FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma japonicum FK506-binding protein 1A, putative Get druggable targets OG5_126727 All targets in OG5_126727
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium knowlesi peptidyl-prolyl cis-trans isomerase FKBP35, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma japonicum ko:K09568 FK506-binding protein 1, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania infantum peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei macrophage infectivity potentiator, precursor, putative FK506 binding protein 1A, 12kDa 108 aa 107 aa 48.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Schistosoma mansoni hypothetical protein 0.0047 0.0313 0.0807
Loa Loa (eye worm) RNA binding protein 0.0067 0.0537 0.2006
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0537 0.1384
Onchocerca volvulus Huntingtin homolog 0.014 0.1335 0.474
Loa Loa (eye worm) hypothetical protein 0.014 0.1335 0.4987
Brugia malayi Nuclear hormone receptor-like 1 0.0022 0.0047 0.0177
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0065 0.0516 0.1928
Schistosoma mansoni hypothetical protein 0.0329 0.3403 0.8769
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0022 0.0047 0.0122
Loa Loa (eye worm) FKBP5 protein 0.0065 0.0516 0.1928
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0079 0.067 0.0674
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0065 0.0516 0.133
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0022 0.0047 0.0177
Loa Loa (eye worm) transcription factor SMAD2 0.0263 0.2676 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0022 0.0047 0.0122
Loa Loa (eye worm) hypothetical protein 0.0034 0.0177 0.0662
Schistosoma mansoni patched 1 0.0048 0.0332 0.0856
Echinococcus multilocularis Niemann Pick C1 protein 0.0161 0.1562 0.1572
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.0065 0.0516 1
Echinococcus multilocularis isocitrate dehydrogenase 0.0035 0.0184 0.0186
Brugia malayi photoreceptor-specific nuclear receptor 0.0022 0.0047 0.0177
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0537 0.1384
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0056 0.0418 0.1078
Loa Loa (eye worm) steroid hormone receptor 0.0022 0.0047 0.0177
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0022 0.0047 0.0177
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0537 0.1384
Mycobacterium ulcerans proteasome PrcA 0.0933 1 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0238 0.2404 0.8982
Schistosoma mansoni hypothetical protein 0.0373 0.3881 1
Echinococcus multilocularis tar DNA binding protein 0.0067 0.0537 0.0541
Leishmania major peptidylprolyl isomerase-like protein 0.0065 0.0516 1
Schistosoma mansoni immunophilin 0.0056 0.0418 0.1078
Echinococcus multilocularis FTZ F1 alpha 0.0022 0.0047 0.0048
Brugia malayi hypothetical protein 0.025 0.2539 0.9488
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0177 0.0457
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0022 0.0047 0.0122
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0333 0.0859
Loa Loa (eye worm) MH2 domain-containing protein 0.0263 0.2676 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0022 0.0047 0.0122
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0022 0.0047 0.0048
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0022 0.0047 0.0177
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0537 0.1384
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0065 0.0516 0.5
Brugia malayi nuclear hormone receptor 0.0022 0.0047 0.0177
Loa Loa (eye worm) hypothetical protein 0.0059 0.0451 0.1684
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Trichomonas vaginalis fk506-binding protein, putative 0.0065 0.0516 0.0757
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0333 0.1246
Echinococcus multilocularis thyroid hormone receptor alpha 0.0022 0.0047 0.0048
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.0516 1
Echinococcus multilocularis sterol regulatory element binding protein 0.0048 0.0332 0.0334
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0022 0.0047 0.0177
Onchocerca volvulus 0.0034 0.0177 0.0478
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0333 0.0336
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0035 0.0184 0.0186
Schistosoma mansoni thyroid hormone receptor 0.0022 0.0047 0.0122
Brugia malayi RNA binding protein 0.0067 0.0537 0.2006
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0022 0.0047 0.0122
Schistosoma mansoni steroid hormone receptor ad4bp 0.0022 0.0047 0.0122
Brugia malayi RNA recognition motif domain containing protein 0.0067 0.0537 0.2006
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0333 0.1246
Schistosoma mansoni immunophilin 0.0065 0.0516 0.133
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0022 0.0047 0.0048
Echinococcus granulosus expressed conserved protein 0.0106 0.0959 0.2473
Schistosoma mansoni survival motor neuron protein 0.0051 0.0362 0.0933
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.0516 1
Brugia malayi hypothetical protein 0.0079 0.067 0.2503
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0163 0.0421
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0035 0.0184 0.0212
Loa Loa (eye worm) hypothetical protein 0.0056 0.0418 0.1562
Echinococcus granulosus X box binding protein 1 0.0329 0.3403 0.8769
Entamoeba histolytica hypothetical protein 0.0079 0.067 0.2967
Schistosoma mansoni hypothetical protein 0.0373 0.3881 1
Entamoeba histolytica hypothetical protein 0.0079 0.067 0.2967
Trichomonas vaginalis immunophilin, putative 0.0065 0.0516 0.0757
Schistosoma mansoni hypothetical protein 0.0051 0.0362 0.0933
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0065 0.0516 0.133
Entamoeba histolytica hypothetical protein 0.0079 0.067 0.2967
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0048 0.0332 0.1241
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.0516 1
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0065 0.0516 0.1928
Echinococcus multilocularis ecdysone induced protein 78C 0.0022 0.0047 0.0048
Schistosoma mansoni RAR-like nuclear receptor 0.0022 0.0047 0.0122
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0022 0.0047 0.0122
Echinococcus granulosus tar DNA binding protein 0.0067 0.0537 0.1384
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0022 0.0047 0.0122
Brugia malayi ecdysteroid receptor 0.0022 0.0047 0.0177
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0022 0.0047 0.0177
Brugia malayi Isocitrate dehydrogenase 0.0035 0.0184 0.0689
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0113 0.1034 1
Onchocerca volvulus 0.0051 0.0362 0.1159
Echinococcus multilocularis X box binding protein 1 0.0329 0.3403 0.3426
Loa Loa (eye worm) isocitrate dehydrogenase 0.0035 0.0184 0.0689
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0035 0.0184 0.0475
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0035 0.0184 0.0186
Brugia malayi nuclear receptor NHR-88 0.0022 0.0047 0.0177
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0114 0.1053 0.2714
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative 0.0065 0.0516 0.5
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.0516 1
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0065 0.0516 0.052
Schistosoma mansoni immunophilin 0.0065 0.0516 0.133
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0035 0.0184 0.0186
Leishmania major fk506-binding protein 1-like protein 0.0065 0.0516 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0333 0.0859
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0022 0.0047 0.0177
Echinococcus multilocularis geminin 0.0373 0.3881 0.3907
Echinococcus multilocularis expressed conserved protein 0.0106 0.0959 0.0966
Loa Loa (eye worm) hypothetical protein 0.025 0.2539 0.9488
Toxoplasma gondii isocitrate dehydrogenase 0.0035 0.0184 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0022 0.0047 0.0048
Echinococcus multilocularis Niemann Pick C1 protein 0.0113 0.1034 0.1041
Entamoeba histolytica hypothetical protein 0.0079 0.067 0.2967
Schistosoma mansoni nuclear hormone receptor 0.0022 0.0047 0.0122
Onchocerca volvulus 0.0271 0.2763 1
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0065 0.0516 0.0757
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0022 0.0047 0.0177
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0927 0.9933 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0035 0.0184 0.0475
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0022 0.0047 0.0177
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0022 0.0047 0.0122
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0065 0.0516 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0022 0.0047 0.0048
Loa Loa (eye worm) hypothetical protein 0.0048 0.0332 0.1241
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0051 0.0362 0.1353
Brugia malayi TAR-binding protein 0.0067 0.0537 0.2006
Echinococcus multilocularis survival motor neuron protein 1 0.025 0.2539 0.2556
Schistosoma mansoni retinoic acid receptor RXR 0.0022 0.0047 0.0122
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0022 0.0047 0.0177
Brugia malayi steroid hormone receptor 0.0022 0.0047 0.0177
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0022 0.0047 0.0122
Schistosoma mansoni transcription factor LCR-F1 0.0079 0.067 0.1726
Echinococcus granulosus FTZ F1 alpha 0.0022 0.0047 0.0122
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0067 0.0537 0.2006
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Loa Loa (eye worm) TAR-binding protein 0.0067 0.0537 0.2006
Echinococcus granulosus geminin 0.0373 0.3881 1
Echinococcus multilocularis fk506 binding protein 0.0065 0.0516 0.052
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0065 0.0516 0.1928
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0177 0.0178
Brugia malayi Steroid receptor seven-up type 2 0.0022 0.0047 0.0177
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0022 0.0047 0.0177
Brugia malayi MH2 domain containing protein 0.0263 0.2676 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0022 0.0047 0.0177
Brugia malayi hypothetical protein 0.014 0.1335 0.4987
Trichomonas vaginalis set domain proteins, putative 0.0271 0.2763 1
Echinococcus multilocularis protein patched 0.0048 0.0332 0.0334
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0022 0.0047 0.0177
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0022 0.0047 0.0177
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.0516 1
Schistosoma mansoni coup transcription factor 0.0022 0.0047 0.0122
Onchocerca volvulus Huntingtin homolog 0.014 0.1335 0.474
Echinococcus granulosus Niemann Pick C1 protein 0.0161 0.1562 0.4025
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0022 0.0047 0.0177
Loa Loa (eye worm) hypothetical protein 0.0113 0.1034 0.3864
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0022 0.0047 0.0177
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0022 0.0047 0.0177
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0022 0.0047 0.0048
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0333 0.0336
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0333 0.0859
Echinococcus multilocularis protein dispatched 1 0.0055 0.0407 0.0409
Loa Loa (eye worm) hypothetical protein 0.0022 0.0047 0.0177
Brugia malayi Pre-SET motif family protein 0.0238 0.2404 0.8982
Brugia malayi Niemann-Pick C1 protein precursor 0.0113 0.1034 0.3864
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0177 0.0178
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0022 0.0047 0.0048
Schistosoma mansoni hypothetical protein 0.0079 0.067 0.1726
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0022 0.0047 0.0122
Toxoplasma gondii isocitrate dehydrogenase 0.0035 0.0184 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0333 0.0859
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0079 0.067 0.1726
Echinococcus granulosus survival motor neuron protein 1 0.025 0.2539 0.6543
Mycobacterium tuberculosis Proteasome alpha subunit PrcA; assembles with beta subunit PrcB. 0.0933 1 1
Schistosoma mansoni hypothetical protein 0.0047 0.0313 0.0807
Brugia malayi isocitrate dehydrogenase 0.0035 0.0184 0.0689
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0022 0.0047 0.0177
Brugia malayi CHE-14 protein 0.0048 0.0332 0.1241
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0177 0.0457
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0035 0.0184 0.0186
Brugia malayi Pre-SET motif family protein 0.0034 0.0177 0.0662
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0333 0.0859
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0537 0.1384
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0022 0.0047 0.0122
Echinococcus granulosus Niemann Pick C1 protein 0.0113 0.1034 0.2665
Echinococcus granulosus ecdysone induced protein 78C 0.0022 0.0047 0.0122
Schistosoma mansoni hypothetical protein 0.0047 0.0313 0.0807
Loa Loa (eye worm) hypothetical protein 0.014 0.1335 0.4987
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0022 0.0047 0.0122
Echinococcus granulosus Protein patched homolog 1 0.0048 0.0332 0.0856
Schistosoma mansoni thyroid hormone receptor 0.0022 0.0047 0.0122
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.0516 1
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0056 0.0418 0.0421
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0065 0.0516 0.0757
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.0065 0.0516 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0022 0.0047 0.0122
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0065 0.0516 0.133
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0177 0.0457
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0177 0.0457
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0177 0.0457
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0022 0.0047 0.0177
Schistosoma mansoni hypothetical protein 0.0047 0.0313 0.0807
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0022 0.0047 0.0177
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0022 0.0047 0.0177
Echinococcus granulosus sterol regulatory element binding protein 0.0048 0.0332 0.0856

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 0.79 uM Apparent inhibition constant of Wild-type human recombinant FK506 binding protein 12 ChEMBL. 8627611
Ki app (binding) = 0.79 uM Apparent inhibition constant of Wild-type human recombinant FK506 binding protein 12 ChEMBL. 8627611

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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