Detailed information for compound 139897

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 623.743 | Formula: C32H45N7O6
  • H donors: 4 H acceptors: 8 LogP: 2.42 Rotable bonds: 19
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCCC(C(=O)C(=O)NC1CC1)NC(=O)[C@@H]1[C@H]2CC=C[C@H]2CN1C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)c1nccnc1
  • InChi: 1S/C32H45N7O6/c1-6-8-22(27(40)31(44)35-20-11-12-20)36-30(43)26-21-10-7-9-19(21)16-39(26)32(45)25(18(4)5)38-29(42)24(17(2)3)37-28(41)23-15-33-13-14-34-23/h7,9,13-15,17-22,24-26H,6,8,10-12,16H2,1-5H3,(H,35,44)(H,36,43)(H,37,41)(H,38,42)/t19-,21-,22?,24-,25-,26-/m0/s1
  • InChiKey: VLBZYSGENGZHRB-YOAIMQRKSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Human rhinovirus sp. Human rhinovirus A protease Starlite/ChEMBL References

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
Echinococcus multilocularis ubiquitin specific protease 41 0.0039 0.1498 0.1356
Mycobacterium tuberculosis Probable dehydrogenase 0.0116 0.6177 0.8837
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.3436 1
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0768 0.0768
Echinococcus granulosus transcription factor Dp 1 0.0041 0.1616 0.1476
Schistosoma mansoni lamin 0.0027 0.0768 0.0685
Echinococcus multilocularis thioredoxin glutathione reductase 0.0051 0.221 0.208
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.3436 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Echinococcus multilocularis GPCR, family 2 0.0017 0.0167 0.0003
Echinococcus granulosus pyruvate kinase 0.0034 0.116 0.1013
Trypanosoma brucei pyruvate kinase 1, putative 0.0034 0.116 0.3352
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.787 0.8733
Schistosoma mansoni intermediate filament proteins 0.0027 0.0768 0.0685
Loa Loa (eye worm) pyruvate kinase-PB 0.0023 0.0541 0.0541
Brugia malayi Pyruvate kinase, M2 isozyme 0.0034 0.116 0.116
Echinococcus multilocularis transcription factor Dp 1 0.0041 0.1616 0.1476
Trichomonas vaginalis ap endonuclease, putative 0.004 0.1545 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0179 1 1
Brugia malayi TAR-binding protein 0.007 0.3346 0.3346
Toxoplasma gondii thioredoxin reductase 0.0051 0.221 1
Trypanosoma cruzi pyruvate kinase 2, putative 0.0034 0.116 0.3352
Trichomonas vaginalis mercuric reductase, putative 0.0018 0.0186 0.1131
Echinococcus granulosus tar DNA binding protein 0.007 0.3346 0.3235
Schistosoma mansoni hypothetical protein 0.0017 0.0167 0.0004
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0055 0.2445 0.2445
Trypanosoma brucei trypanothione reductase 0.0051 0.221 0.6417
Echinococcus multilocularis pyruvate kinase 0.0034 0.116 0.1013
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0018 0.0186 0.0023
Trichomonas vaginalis pyruvate kinase, putative 0.0034 0.116 0.749
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.787 0.7834
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0071 0.3436 1
Leishmania major pyruvate kinase 0.0034 0.116 0.3352
Loa Loa (eye worm) hypothetical protein 0.0039 0.1498 0.1498
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.1529 0.1529
Plasmodium vivax thioredoxin reductase, putative 0.0051 0.221 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.004 0.1545 0.1404
Brugia malayi RNA binding protein 0.007 0.3346 0.3346
Echinococcus multilocularis musashi 0.0027 0.0768 0.0614
Echinococcus granulosus intermediate filament protein 0.0027 0.0768 0.0614
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0116 0.6177 0.8837
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1529 0.4429
Loa Loa (eye worm) glutathione reductase 0.0051 0.221 0.221
Schistosoma mansoni pyruvate kinase 0.0034 0.116 0.1129
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1529 0.9897
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0039 0.1498 0.4337
Mycobacterium tuberculosis Probable reductase 0.0116 0.6177 0.8837
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.004 0.1545 0.4475
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1529 0.4429
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0039 0.1498 0.1356
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.0167 0.0003
Schistosoma mansoni tar DNA-binding protein 0.007 0.3346 0.3606
Trichomonas vaginalis ap endonuclease, putative 0.004 0.1545 1
Schistosoma mansoni tar DNA-binding protein 0.007 0.3346 0.3606
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0039 0.1498 0.9658
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.787 0.7834
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0186 0.0506
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.116 0.2126
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0018 0.0186 0.0109
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0034 0.116 0.1437
Schistosoma mansoni tar DNA-binding protein 0.007 0.3346 0.3606
Toxoplasma gondii exonuclease III APE 0.004 0.1545 0.675
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.1529 0.9897
Trypanosoma brucei pyruvate kinase 1 0.0034 0.116 0.3352
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Loa Loa (eye worm) pyruvate kinase 0.0034 0.116 0.116
Schistosoma mansoni alpha-glucosidase 0.0154 0.8484 0.9429
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0018 0.0186 0.0023
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0018 0.0186 0.0186
Plasmodium falciparum thioredoxin reductase 0.0018 0.0186 0.0109
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0186 0.0506
Schistosoma mansoni alpha glucosidase 0.004 0.1529 0.1547
Loa Loa (eye worm) RNA binding protein 0.007 0.3346 0.3346
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0039 0.1498 0.4337
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0071 0.3436 0.3327
Giardia lamblia Pyruvate kinase 0.0034 0.116 0.7215
Schistosoma mansoni lamin 0.0027 0.0768 0.0685
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.1545 0.675
Echinococcus granulosus ubiquitin specific protease 41 0.0039 0.1498 0.1356
Schistosoma mansoni tar DNA-binding protein 0.007 0.3346 0.3606
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.1529 0.1529
Loa Loa (eye worm) pyruvate kinase 0.0034 0.116 0.116
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.004 0.1545 1
Mycobacterium ulcerans pyruvate kinase 0.0034 0.116 0.717
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0071 0.3436 0.3436
Leishmania major pyruvate kinase 0.0034 0.116 0.3352
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0039 0.1498 0.4337
Mycobacterium tuberculosis Probable oxidoreductase 0.0129 0.6965 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1529 0.9897
Brugia malayi Calcitonin receptor-like protein seb-1 0.0055 0.2445 0.2445
Loa Loa (eye worm) hypothetical protein 0.0027 0.0768 0.0768
Brugia malayi latrophilin 2 splice variant baaae 0.0037 0.1391 0.1391
Onchocerca volvulus 0.0027 0.0768 0.1399
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1529 0.9897
Schistosoma mansoni hypothetical protein 0.0017 0.0167 0.0004
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0129 0.6965 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.004 0.1545 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1529 0.4429
Plasmodium vivax glutathione reductase, putative 0.0051 0.221 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0116 0.6177 0.8837
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0039 0.1498 0.1498
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0071 0.3436 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1529 0.4429
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.787 0.8733
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.007 0.3346 0.3346
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0116 0.6177 0.8837
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0039 0.1498 0.9692
Plasmodium falciparum pyruvate kinase 0.0034 0.116 0.487
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0018 0.0186 0.0109
Echinococcus granulosus thioredoxin glutathione reductase 0.0051 0.221 0.208
Onchocerca volvulus 0.0103 0.541 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.1529 0.6673
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.1529 0.9897
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.1545 0.675
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.1529 0.1388
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Brugia malayi Glycosyl hydrolases family 31 protein 0.0015 0.0013 0.0013
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.1498 0.9692
Trichomonas vaginalis pyruvate kinase, putative 0.0034 0.116 0.749
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0129 0.6965 1
Echinococcus multilocularis lamin dm0 0.0027 0.0768 0.0614
Brugia malayi Pyruvate kinase, muscle isozyme 0.0034 0.116 0.116
Plasmodium falciparum glutathione reductase 0.0051 0.221 1
Schistosoma mansoni ap endonuclease 0.004 0.1545 0.1565
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0129 0.6965 1
Brugia malayi glutathione reductase 0.0051 0.221 0.221
Entamoeba histolytica pyruvate kinase, putative 0.0023 0.0541 0.1542
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0018 0.0186 0.0506
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0018 0.0186 0.0506
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0018 0.0186 0.0109
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0144 0.787 0.787
Toxoplasma gondii pyruvate kinase PyK1 0.0034 0.116 0.487
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0039 0.1498 0.1511
Loa Loa (eye worm) hypothetical protein 0.0023 0.0541 0.0541
Loa Loa (eye worm) TAR-binding protein 0.007 0.3346 0.3346
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0051 0.221 0.2985
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.004 0.1545 0.2004
Trypanosoma cruzi trypanothione reductase, putative 0.0051 0.221 0.6417
Leishmania major alpha glucosidase II subunit, putative 0.004 0.1529 0.4429
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0071 0.3436 0.3327
Trypanosoma brucei glucosidase, putative 0.004 0.1529 0.4429
Schistosoma mansoni tar DNA-binding protein 0.007 0.3346 0.3606
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0039 0.1498 0.4337
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.0167 0.0167
Echinococcus multilocularis tar DNA binding protein 0.007 0.3346 0.3235
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1529 0.9897
Echinococcus granulosus GPCR family 2 0.0017 0.0167 0.0003
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.787 0.7834
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0167 0.0167
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0186 0.0506
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.0167 0.0003
Onchocerca volvulus 0.0027 0.0768 0.1399
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.004 0.1545 0.4475
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0768 0.0768
Schistosoma mansoni alpha-glucosidase 0.0154 0.8484 0.9429
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.0167 0.0003
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0186 0.0506
Brugia malayi intermediate filament protein 0.0027 0.0768 0.0768
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.3436 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.004 0.1545 0.4475
Loa Loa (eye worm) hypothetical protein 0.0034 0.116 0.116
Entamoeba histolytica exodeoxyribonuclease III, putative 0.004 0.1545 0.4475
Trypanosoma cruzi pyruvate kinase 2, putative 0.0034 0.116 0.3352
Schistosoma mansoni hypothetical protein 0.0037 0.1391 0.139
Brugia malayi Thioredoxin reductase 0.0051 0.221 0.221
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0071 0.3436 0.3708
Loa Loa (eye worm) hypothetical protein 0.0027 0.0738 0.0738
Echinococcus granulosus pyruvate kinase 0.0034 0.116 0.1013
Loa Loa (eye worm) hypothetical protein 0.0055 0.2445 0.2445
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0039 0.1498 0.4337
Echinococcus multilocularis lysosomal alpha glucosidase 0.0179 1 1
Schistosoma mansoni ap endonuclease 0.004 0.1545 0.1565
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0018 0.0186 0.0109
Schistosoma mansoni hypothetical protein 0.0017 0.0167 0.0004
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0039 0.1498 0.1511
Loa Loa (eye worm) hypothetical protein 0.0037 0.1391 0.1391
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0179 1 1
Echinococcus multilocularis pyruvate kinase 0.0027 0.0729 0.0574
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.004 0.1545 0.1404
Loa Loa (eye worm) hypothetical protein 0.0017 0.0167 0.0167
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0039 0.1498 0.1356
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.004 0.1545 0.1545
Loa Loa (eye worm) transcription factor SMAD2 0.0128 0.6931 0.6931
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0018 0.0186 0.0506
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0039 0.1498 0.1356
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.116 0.2126
Loa Loa (eye worm) thioredoxin reductase 0.0051 0.221 0.221
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0039 0.1498 0.9692
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.0167 0.0003
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1529 0.9897
Plasmodium vivax pyruvate kinase, putative 0.0034 0.116 0.487
Plasmodium falciparum thioredoxin reductase 0.0051 0.221 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0071 0.3436 0.3436
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1529 0.9897
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0144 0.787 0.787
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.787 0.8733
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0116 0.6177 0.8837
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0116 0.6177 0.8642
Echinococcus granulosus lamin 0.0027 0.0768 0.0614
Echinococcus multilocularis pyruvate kinase 0.0034 0.116 0.1013
Brugia malayi RNA recognition motif domain containing protein 0.007 0.3346 0.3346
Plasmodium falciparum glutathione reductase 0.0018 0.0186 0.0109
Brugia malayi exodeoxyribonuclease III family protein 0.004 0.1545 0.1545
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.787 0.7834
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0018 0.0186 0.0109
Trichomonas vaginalis glutathione reductase, putative 0.0018 0.0186 0.1131
Toxoplasma gondii NADPH-glutathione reductase 0.0018 0.0186 0.0109
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0018 0.0186 0.0506
Chlamydia trachomatis pyruvate kinase 0.0034 0.116 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0167 0.0167
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0055 0.2445 0.2445
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0768 0.0768
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0018 0.0186 0.0025
Echinococcus multilocularis lamin 0.0027 0.0768 0.0614
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.004 0.1545 1
Schistosoma mansoni pyruvate kinase 0.0034 0.116 0.1129
Loa Loa (eye worm) hypothetical protein 0.0015 0.0013 0.0013
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0039 0.1498 0.1356
Giardia lamblia NADH oxidase lateral transfer candidate 0.0018 0.0186 0.0162
Loa Loa (eye worm) MH2 domain-containing protein 0.0128 0.6931 0.6931
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0186 0.0506
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.116 0.2126
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.1529 0.1388
Schistosoma mansoni hypothetical protein 0.0017 0.0167 0.0004
Loa Loa (eye worm) pyruvate kinase 0.0034 0.116 0.116
Treponema pallidum exodeoxyribonuclease (exoA) 0.004 0.1545 1
Echinococcus granulosus lamin dm0 0.0027 0.0768 0.0614
Brugia malayi MH2 domain containing protein 0.0128 0.6931 0.6931
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.004 0.1545 0.4475
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1529 0.9897
Trypanosoma cruzi trypanothione reductase, putative 0.0018 0.0186 0.0506
Leishmania major trypanothione reductase 0.0051 0.221 0.6417
Echinococcus multilocularis lysosomal alpha glucosidase 0.0179 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 100 uM Cytotoxic activity against Protease in rat liver Huh-7 cells ChEMBL. 14684337
IC50 (binding) > 100 uM Cytotoxic activity against Protease in rat liver Huh-7 cells ChEMBL. 14684337
Inhibition (binding) = -57 % Inhibitory activity against Protease using replicon assay in rats at 25 microM concentration ChEMBL. 14684337
Inhibition (binding) = -57 % Inhibitory activity against Protease using replicon assay in rats at 25 microM concentration ChEMBL. 14684337
Ki (binding) = 0.09 uM Binding affinity towards Protease using PNA assay in rats ChEMBL. 14684337
Ki (binding) = 0.09 uM Binding affinity towards Protease using PNA assay in rats ChEMBL. 14684337

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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