Detailed information for compound 1854860

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 916.077 | Formula: C46H65N11O9
  • H donors: 8 H acceptors: 9 LogP: 0.94 Rotable bonds: 26
    Rule of 5 violations (Lipinski): 3
  • SMILES: OC[C@@H](C(=O)N(C(C(=O)N)C)C)NC(=O)[C@@H]1Cc2c3N1C(=O)[C@H](CCc3ccc2)NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CC1CCCCC1)CCCN=C(N)N)C)c1ccccc1
  • InChi: 1S/C46H65N11O9/c1-26(39(47)60)55(3)44(65)35(25-58)54-41(62)36-24-31-18-11-17-30-20-21-33(45(66)57(36)37(30)31)53-42(63)38(29-15-9-6-10-16-29)56(4)43(64)32(19-12-22-50-46(48)49)52-40(61)34(51-27(2)59)23-28-13-7-5-8-14-28/h6,9-11,15-18,26,28,32-36,38,58H,5,7-8,12-14,19-25H2,1-4H3,(H2,47,60)(H,51,59)(H,52,61)(H,53,63)(H,54,62)(H4,48,49,50)/t26?,32-,33-,34-,35-,36-,38-/m0/s1
  • InChiKey: XHTWXMBSGVICDV-HQNZVEEXSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0225 0.1007 0.1906
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0108 0.0288 0.0546
Schistosoma mansoni hypothetical protein 0.0135 0.0452 0.0452
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0108 0.0288 0.0288
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.019 0.0792 0.0792
Brugia malayi Armadillo/beta-catenin-like repeat family protein 0.0096 0.0214 0.0406
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Brugia malayi Carboxylesterase family protein 0.019 0.0792 0.15
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Echinococcus multilocularis peroxidasin 0.009 0.018 0.018
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0108 0.0288 0.0288
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0108 0.0288 0.0546
Trichomonas vaginalis conserved hypothetical protein 0.1465 0.8618 0.8571
Trichomonas vaginalis PIKK family atypical protein kinase 0.0787 0.4455 0.4266
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0108 0.0288 0.0288
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0225 0.1007 0.1007
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.0309 0.1522 0.0573
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0436 0.23 0.1725
Brugia malayi steroid hormone receptor 0.0108 0.0288 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0551 0.3005 0.2767
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0225 0.1007 0.1007
Trichomonas vaginalis PIKK family atypical protein kinase 0.0598 0.3297 0.3069
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0922 0.5282 0.4754
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.019 0.0792 0.15
Brugia malayi Animal haem peroxidase family protein 0.009 0.018 0.034
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0108 0.0288 0.0546
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0174 0.0694 0.0694
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0922 0.5282 1
Loa Loa (eye worm) hypothetical protein 0.0809 0.4589 0.8688
Echinococcus granulosus T cell transcription factor 4 long C terminal 0.0064 0.0019 0.0019
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Echinococcus multilocularis thyroid hormone receptor alpha 0.0108 0.0288 0.0288
Trichomonas vaginalis PIKK family atypical protein kinase 0.0618 0.3419 0.3195
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Trichomonas vaginalis PIKK family atypical protein kinase 0.0498 0.2679 0.243
Echinococcus multilocularis muscleblind protein 1 0.0144 0.051 0.051
Echinococcus granulosus hypothetical protein 0.0298 0.1452 0.1452
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0108 0.0288 0.0546
Toxoplasma gondii GAF domain-containing protein 0.0584 0.3206 0.317
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0194 0.0817 0.0154
Trichomonas vaginalis PIKK family atypical protein kinase 0.0309 0.1522 0.1233
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.0335
Plasmodium vivax hypothetical protein, conserved 0.0584 0.3206 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0922 0.5282 0.5121
Loa Loa (eye worm) phosphatidylinositol 3 0.0922 0.5282 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trichomonas vaginalis PIKK family atypical protein kinase 0.0309 0.1522 0.1233
Trichomonas vaginalis PIKK family atypical protein kinase 0.0733 0.4124 0.3924
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0108 0.0288 0.0288
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.169 1 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0922 0.5282 0.5282
Loa Loa (eye worm) steroid hormone receptor 0.0108 0.0288 0.0546
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0174 0.0694 0.0377
Echinococcus multilocularis acetylcholinesterase 0.019 0.0792 0.0792
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0584 0.3206 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0733 0.4124 0.3924
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0922 0.5282 1
Loa Loa (eye worm) acetylcholinesterase 1 0.019 0.0792 0.15
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0809 0.4589 0.4404
Brugia malayi Animal haem peroxidase family protein 0.009 0.018 0.034
Brugia malayi Animal haem peroxidase family protein 0.009 0.018 0.034
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0108 0.0288 0.0288
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0225 0.1007 0.0335
Brugia malayi photoreceptor-specific nuclear receptor 0.0108 0.0288 0.0546
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0108 0.0288 0.0288
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0225 0.1007 0.1007
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0108 0.0288 0.0546
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0584 0.3206 0.5
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0225 0.1007 0.1007
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0108 0.0288 0.0546
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trichomonas vaginalis PIKK family atypical protein kinase 0.0309 0.1522 0.1233
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0108 0.0288 0.0546
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0922 0.5282 0.5121
Echinococcus granulosus FTZ F1 alpha 0.0108 0.0288 0.0288
Brugia malayi Animal haem peroxidase family protein 0.009 0.018 0.034
Trichomonas vaginalis conserved hypothetical protein 0.0194 0.0817 0.0504
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0225 0.1007 0.1007
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.1107 0.6418 0.6296
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.07
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.07
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0108 0.0288 0.0288
Trichomonas vaginalis PIKK family atypical protein kinase 0.0174 0.0694 0.0377
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0809 0.4589 0.4404
Trichomonas vaginalis PIKK family atypical protein kinase 0.0551 0.3005 0.2767
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0922 0.5282 0.5121
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0108 0.0288 0.0546
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0108 0.0288 0.0288
Trichomonas vaginalis conserved hypothetical protein 0.0225 0.1007 0.07
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.1107 0.6418 0.6296
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Echinococcus granulosus muscleblind protein 0.0144 0.051 0.051
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0225 0.1007 0.1906
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0922 0.5282 0.493
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Loa Loa (eye worm) animal heme peroxidase 0.009 0.018 0.034
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0108 0.0288 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0551 0.3005 0.2767
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0174 0.0694 0.0377
Schistosoma mansoni thyroid hormone receptor 0.0108 0.0288 0.0288
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.169 1 1
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0225 0.1007 0.1007
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0108 0.0288 0.0546
Onchocerca volvulus 0.0108 0.0288 1
Schistosoma mansoni peroxidasin 0.009 0.018 0.018
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0135 0.0452 0.0452
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0108 0.0288 0.0546
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0108 0.0288 1
Echinococcus granulosus acetylcholinesterase 0.019 0.0792 0.0792
Onchocerca volvulus Bile acid receptor homolog 0.0108 0.0288 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Toxoplasma gondii hypothetical protein 0.1465 0.8618 1
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Echinococcus granulosus acetylcholinesterase 0.019 0.0792 0.0792
Brugia malayi Peroxidasin 0.009 0.018 0.034
Brugia malayi hypothetical protein 0.009 0.018 0.034
Trichomonas vaginalis conserved hypothetical protein 0.1465 0.8618 0.8571
Loa Loa (eye worm) phosphatidylinositol 3 0.0309 0.1522 0.2881
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0108 0.0288 0.0546
Echinococcus multilocularis beta catenin 0.0096 0.0214 0.0214
Schistosoma mansoni microtubule-associated protein tau 0.054 0.2937 0.2937
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0922 0.5282 0.4754
Echinococcus multilocularis carboxylesterase 5A 0.019 0.0792 0.0792
Trichomonas vaginalis PIKK family atypical protein kinase 0.0497 0.2675 0.2425
Echinococcus granulosus ecdysone induced protein 78C 0.0108 0.0288 0.0288
Loa Loa (eye worm) HMP-2 protein 0.0096 0.0214 0.0406
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0584 0.3206 0.5
Echinococcus multilocularis serine protein kinase ATM 0.0174 0.0694 0.0694
Brugia malayi nuclear receptor NHR-88 0.0108 0.0288 0.0546
Schistosoma mansoni peroxidasin 0.009 0.018 0.018
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0734 0.4129 0.3691
Schistosoma mansoni RAR-like nuclear receptor 0.0108 0.0288 0.0288
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0602 0.3322 0.3322
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0809 0.4589 0.4589
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0309 0.1522 0.1233
Loa Loa (eye worm) hypothetical protein 0.0174 0.0694 0.1315
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0309 0.1522 0.0889
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0225 0.1007 0.1007
Trichomonas vaginalis PIKK family atypical protein kinase 0.0498 0.2679 0.243
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0108 0.0288 0.0288
Loa Loa (eye worm) animal heme peroxidase 0.009 0.018 0.034
Loa Loa (eye worm) hypothetical protein 0.0188 0.0777 0.1472
Loa Loa (eye worm) animal heme peroxidase 0.009 0.018 0.034
Loa Loa (eye worm) hypothetical protein 0.0115 0.0329 0.0624
Trichomonas vaginalis PIKK family atypical protein kinase 0.0922 0.5282 0.5121
Trichomonas vaginalis PIKK family atypical protein kinase 0.0497 0.2675 0.2425
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Loa Loa (eye worm) hypothetical protein 0.0194 0.0817 0.1546
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0922 0.5282 0.5282
Brugia malayi Animal haem peroxidase family protein 0.009 0.018 0.034
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) blistered cuticle protein 3 0.009 0.018 0.034
Loa Loa (eye worm) animal heme peroxidase 0.009 0.018 0.034
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0225 0.1007 0.1906
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Trichomonas vaginalis PIKK family atypical protein kinase 0.0733 0.4124 0.3924
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0922 0.5282 0.493
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0225 0.1007 0.1007
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Toxoplasma gondii target of rapamycin (TOR), putative 0.0686 0.3832 0.396
Echinococcus granulosus beta catenin 0.0096 0.0214 0.0214
Trichomonas vaginalis PIKK family atypical protein kinase 0.0174 0.0694 0.0377
Trichomonas vaginalis PIKK family atypical protein kinase 0.0922 0.5282 0.5121
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Loa Loa (eye worm) hypothetical protein 0.0225 0.1007 0.1906
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Onchocerca volvulus Cirhin homolog 0.0096 0.0211 0.2857
Loa Loa (eye worm) hypothetical protein 0.0225 0.1007 0.1906
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0922 0.5282 0.5282
Trichomonas vaginalis conserved hypothetical protein 0.0584 0.3206 0.2975
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0225 0.1007 0.1007
Trypanosoma brucei hypothetical protein, conserved 0.0225 0.1007 0.0335
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Mycobacterium ulcerans putative regulatory protein 0.0584 0.3206 0.5
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0225 0.1007 0.07
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0309 0.1522 0.0889
Loa Loa (eye worm) HMG box family protein 0.0064 0.0019 0.0036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Schistosoma mansoni pangolin 0.0064 0.0019 0.0019
Schistosoma mansoni fkbp-rapamycin associated protein 0.0174 0.0694 0.0694
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0108 0.0288 0.0546
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0809 0.4589 0.4589
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0108 0.0288 0.0288
Loa Loa (eye worm) hypothetical protein 0.0135 0.0452 0.0855
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trichomonas vaginalis PIKK family atypical protein kinase 0.0733 0.4124 0.3924
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0225 0.1007 0.1007
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0225 0.1007 0.1906
Loa Loa (eye worm) hypothetical protein 0.0144 0.051 0.0966
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Brugia malayi ecdysteroid receptor 0.0108 0.0288 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Mycobacterium leprae conserved hypothetical protein 0.0584 0.3206 0.5
Toxoplasma gondii hypothetical protein 0.0584 0.3206 0.317
Schistosoma mansoni nuclear hormone receptor 0.0108 0.0288 0.0288
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) carboxylesterase 0.019 0.0792 0.15
Brugia malayi Muscleblind-like protein 0.0144 0.051 0.0966
Trichomonas vaginalis conserved hypothetical protein 0.1465 0.8618 0.8571
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0225 0.1007 0.1906
Echinococcus granulosus pangolin 0.0064 0.0019 0.0019
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.07
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0174 0.0694 0.0377
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0108 0.0288 0.0288
Schistosoma mansoni retinoic acid receptor RXR 0.0602 0.3322 0.3322
Mycobacterium ulcerans putative regulatory protein 0.0584 0.3206 0.5
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Echinococcus multilocularis protein pangolin J 0.0064 0.0019 0.0019
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.1107 0.6418 0.6296
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0809 0.4589 0.8688
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0135 0.0452 0.0452
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Brugia malayi FAT domain containing protein 0.0135 0.0452 0.0855
Echinococcus multilocularis ecdysone induced protein 78C 0.0108 0.0288 0.0288
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0922 0.5282 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0108 0.0288 0.0546
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0108 0.0288 0.0546
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0309 0.1522 0.1233
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0108 0.0288 0.0288
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0309 0.1522 0.1522
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0383 0.1974 0.1375
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0309 0.1522 0.1522
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0108 0.0288 0.0288
Onchocerca volvulus Protein ultraspiracle homolog 0.0108 0.0288 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0809 0.4589 0.8688
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Schistosoma mansoni beta-catenin 0.0096 0.0214 0.0214
Trichomonas vaginalis PIKK family atypical protein kinase 0.0686 0.3832 0.3622
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0108 0.0288 0.0546
Brugia malayi Blistered cuticle protein 3 0.009 0.018 0.034
Trypanosoma brucei cAMP-specific phosphodiesterase 0.169 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0309 0.1522 0.1233
Trypanosoma brucei cAMP-specific phosphodiesterase 0.169 1 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0545 0.2971 0.2971
Loa Loa (eye worm) hypothetical protein 0.019 0.0792 0.15
Echinococcus granulosus serine protein kinase ATM 0.0174 0.0694 0.0694
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0809 0.4589 0.4404
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0225 0.1007 0.07
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Loa Loa (eye worm) hypothetical protein 0.009 0.018 0.034
Brugia malayi Nuclear hormone receptor-like 1 0.0108 0.0288 0.0546
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0309 0.1522 0.2881
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.0584 0.3206 0.6071
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0108 0.0288 0.0546
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0225 0.1007 0.07
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.0335
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0225 0.1007 0.07
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Echinococcus granulosus carboxylesterase 5A 0.019 0.0792 0.0792
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0734 0.4129 0.3472
Schistosoma mansoni hypothetical protein 0.0234 0.1061 0.1061
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Giardia lamblia GTOR 0.0922 0.5282 1
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0225 0.1007 0.1007
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.169 1 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0225 0.1007 0.1007
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0108 0.0288 0.0288
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0225 0.1007 0.0335
Trichomonas vaginalis PIKK family atypical protein kinase 0.0733 0.4124 0.3924
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Echinococcus multilocularis acetylcholinesterase 0.019 0.0792 0.0792
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0225 0.1007 0.0394
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Loa Loa (eye worm) hypothetical protein 0.0225 0.1007 0.1906
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0108 0.0288 0.0288
Loa Loa (eye worm) hypothetical protein 0.0108 0.0288 0.0546
Toxoplasma gondii hypothetical protein 0.0584 0.3206 0.317
Plasmodium falciparum GAF domain-related protein, putative 0.0584 0.3206 1
Echinococcus multilocularis microtubule associated protein 2 0.054 0.2937 0.2937
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0108 0.0288 0.0546
Echinococcus multilocularis FTZ F1 alpha 0.0108 0.0288 0.0288
Echinococcus granulosus peroxidasin 0.009 0.018 0.018
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0174 0.0694 0.1315
Trichomonas vaginalis conserved hypothetical protein 0.0225 0.1007 0.07
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0108 0.0288 0.0288
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0225 0.1007 0.07
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0497 0.2675 0.2425
Trichomonas vaginalis PIKK family atypical protein kinase 0.0545 0.2971 0.2732
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0309 0.1522 0.1233
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.169 1 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0108 0.0288 0.0288
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0174 0.0694 0.0694
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0108 0.0288 0.0546
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0174 0.0694 0.1315
Trichomonas vaginalis PIKK family atypical protein kinase 0.0498 0.2679 0.243
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0225 0.1007 0.1007
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Loa Loa (eye worm) hypothetical protein 0.0144 0.051 0.0966
Brugia malayi HMG box family protein 0.0064 0.0019 0.0036
Trichomonas vaginalis PIKK family atypical protein kinase 0.0247 0.1142 0.0841
Brugia malayi nuclear hormone receptor 0.0108 0.0288 0.0546
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0174 0.0694 0.0694
Brugia malayi Steroid receptor seven-up type 2 0.0108 0.0288 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0545 0.2971 0.2732
Trypanosoma cruzi hypothetical protein, conserved 0.0225 0.1007 0.07
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0309 0.1522 0.1522
Schistosoma mansoni thyroid hormone receptor 0.0108 0.0288 0.0288
Trichomonas vaginalis conserved hypothetical protein 0.169 1 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0225 0.1007 0.07
Trichomonas vaginalis PIKK family atypical protein kinase 0.0498 0.2679 0.243
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0225 0.1007 0.1007
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0225 0.1007 0.1007
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.169 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0135 0.0452 0.0126
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0108 0.0288 0.0288
Brugia malayi Carboxylesterase family protein 0.019 0.0792 0.15
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0108 0.0288 0.0546
Schistosoma mansoni coup transcription factor 0.0108 0.0288 0.0288
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0809 0.4589 0.4589
Echinococcus multilocularis T cell transcription factor 4 long C terminal 0.0064 0.0019 0.0019
Trypanosoma cruzi target of rapamycin kinase 3 0.0734 0.4129 0.3929
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0309 0.1522 0.0573
Loa Loa (eye worm) PDE1B protein 0.0225 0.1007 0.1906
Schistosoma mansoni steroid hormone receptor ad4bp 0.0108 0.0288 0.0288
Echinococcus granulosus microtubule associated protein 2 0.054 0.2937 0.2937
Echinococcus multilocularis muscleblind protein 0.0144 0.051 0.051

Activities

Activity type Activity value Assay description Source Reference
Degradation (binding) = 141 % Percent degraded by the cathepsin B after incubation for 4 hrs was determined by HPLC ChEMBL. 10841792

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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