Detailed information for compound 1488479

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 576.701 | Formula: C29H40N2O8S
  • H donors: 2 H acceptors: 4 LogP: 3.95 Rotable bonds: 14
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc(cc1)S(=O)(=O)N(C[C@H]([C@H](Cc1ccccc1)NC(=O)O[C@H]1CCO[C@@H]2[C@H]1CCO2)O)CC(C)C
  • InChi: 1S/C29H40N2O8S/c1-20(2)18-31(40(34,35)23-11-9-22(36-3)10-12-23)19-26(32)25(17-21-7-5-4-6-8-21)30-29(33)39-27-14-16-38-28-24(27)13-15-37-28/h4-12,20,24-28,32H,13-19H2,1-3H3,(H,30,33)/t24-,25-,26+,27-,28+/m0/s1
  • InChiKey: JOCIWRMOTYJUAO-AJIIGFCHSA-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 immunodeficiency virus 1 Protease Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) Get druggable targets OG5_131408 All targets in OG5_131408
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica retroviral aspartyl protease domain-containing protein Protease   99 aa 102 aa 32.4 %
Entamoeba histolytica retroviral aspartyl protease domain-containing protein Protease   99 aa 102 aa 32.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0015 0.0012 0.0117
Schistosoma mansoni hypothetical protein 0.0016 0.0021 0.0009
Schistosoma mansoni tar DNA-binding protein 0.0061 0.03 0.0309
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0021 0.0013
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0233 0.0891
Plasmodium vivax acyl-CoA synthetase, putative 0.0037 0.0151 0.7088
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0029 0.01 0.037
Schistosoma mansoni tar DNA-binding protein 0.0061 0.03 0.0309
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0233 0.0864
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0049 0.0228 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0151 0.0568
Loa Loa (eye worm) hypothetical protein 0.0014 0.0008 0.0013
Loa Loa (eye worm) MH2 domain-containing protein 0.0127 0.0706 0.2736
Onchocerca volvulus 0.0029 0.01 0.0342
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0051 0.024 1
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0278 0.1635 0.174
Brugia malayi jmjC domain containing protein 0.0038 0.0154 0.0556
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0051 0.024 1
Chlamydia trachomatis glycogen phosphorylase 0.0429 0.2565 1
Echinococcus granulosus Glycosyl transferase family 35 0.0429 0.2565 0.6083
Mycobacterium ulcerans glycogen phosphorylase GlgP 0.0185 0.1065 0.6844
Schistosoma mansoni glycogen phosphorylase 0.0185 0.1065 0.1129
Echinococcus multilocularis lamin 0.0029 0.01 0.0092
Schistosoma mansoni hypothetical protein 0.0051 0.0239 0.0243
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.024 0.0891
Loa Loa (eye worm) transcription factor SMAD2 0.0127 0.0706 0.2736
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.024 0.0891
Brugia malayi jmjC domain containing protein 0.0102 0.0549 0.2102
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0154 0.0152
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0021 0.0013
Echinococcus multilocularis mitochondrial import inner membrane translocase subunit TIM23, putative 0.0039 0.0164 0.0156
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0015 0.0012 0.0117
Entamoeba histolytica acyl-CoA synthetase, putative 0.0049 0.0228 0.0843
Echinococcus granulosus lamin dm0 0.0029 0.01 0.0218
Echinococcus granulosus expressed protein 0.0046 0.0207 0.0473
Echinococcus granulosus glycogen phosphorylase 0.0429 0.2565 0.6083
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0049 0.0228 0.1398
Loa Loa (eye worm) hypothetical protein 0.0102 0.0551 0.2131
Plasmodium falciparum mitochondrial import inner membrane translocase subunit TIM23, putative 0.0039 0.0164 0.7797
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0051 0.024 1
Entamoeba histolytica glycogen phosphorylase, putative 0.0429 0.2565 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0228 0.0869
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0021 0.003
Echinococcus multilocularis glycogen phosphorylase 0.0429 0.2565 0.2559
Loa Loa (eye worm) hypothetical protein 0.0037 0.0151 0.0568
Echinococcus granulosus lysine specific demethylase 5A 0.0038 0.0154 0.0347
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0135 0.048
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0015 0.0012 0.0117
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0112 0.0612 0.0604
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0015 0.0012 0.0117
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0102 0.0549 0.1286
Loa Loa (eye worm) hypothetical protein 0.0015 0.0012 0.0029
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0215 0.0217
Brugia malayi glutaminase DH11.1 0.0264 0.1551 0.6027
Echinococcus granulosus GPCR family 2 0.0016 0.0021 0.003
Onchocerca volvulus 0.0049 0.0228 0.0843
Schistosoma mansoni hypothetical protein 0.0016 0.0021 0.0009
Echinococcus granulosus glycogen phosphorylase 0.0429 0.2565 0.6083
Loa Loa (eye worm) hypothetical protein 0.0037 0.0151 0.0568
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0049 0.0228 0.1398
Brugia malayi hypothetical protein 0.0112 0.0612 0.2349
Echinococcus multilocularis expressed protein 0.0046 0.0207 0.0199
Onchocerca volvulus 0.0029 0.01 0.0342
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0051 0.024 0.0917
Loa Loa (eye worm) hypothetical protein 0.0251 0.1473 0.5734
Toxoplasma gondii mitochondrial import inner membrane translocase subunit TIM10, putative 0.0046 0.0207 0.8566
Schistosoma mansoni glycogen phosphorylase 0.0429 0.2565 0.2737
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.03 0.1127
Schistosoma mansoni serine/threonine protein kinase 0.0051 0.024 0.0244
Entamoeba histolytica hypothetical protein 0.0112 0.0612 0.2349
Echinococcus multilocularis lamin dm0 0.0029 0.01 0.0092
Giardia lamblia Glycogen phosphorylase 0.0429 0.2565 1
Schistosoma mansoni hypothetical protein 0.0034 0.0135 0.0131
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0021 0.0034
Loa Loa (eye worm) hypothetical protein 0.0016 0.0021 0.0063
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0215 0.0217
Loa Loa (eye worm) oxidoreductase 0.0015 0.0012 0.0029
Schistosoma mansoni cellular tumor antigen P53 0.0102 0.0551 0.0577
Brugia malayi MH2 domain containing protein 0.0127 0.0706 0.2715
Echinococcus multilocularis lysine specific demethylase 5A 0.0038 0.0154 0.0146
Loa Loa (eye worm) RNA binding protein 0.0061 0.03 0.1153
Loa Loa (eye worm) TAR-binding protein 0.0061 0.03 0.1153
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0015 0.0012 0.001
Echinococcus granulosus muscleblind protein 0.0149 0.084 0.1978
Schistosoma mansoni survival motor neuron protein 0.0051 0.0239 0.0243
Brugia malayi RNA binding protein 0.0061 0.03 0.1127
Onchocerca volvulus 0.0102 0.0551 0.2109
Brugia malayi Intermediate filament tail domain containing protein 0.0029 0.01 0.0342
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.03 0.1153
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0051 0.024 1
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.024 0.0891
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0114 0.0106
Echinococcus granulosus geminin 0.018 0.1034 0.244
Schistosoma mansoni hypothetical protein 0.0112 0.0612 0.0643
Schistosoma mansoni hypothetical protein 0.0031 0.0114 0.0109
Schistosoma mansoni hypothetical protein 0.018 0.1034 0.1095
Loa Loa (eye worm) hypothetical protein 0.0015 0.0012 0.0029
Schistosoma mansoni tar DNA-binding protein 0.0061 0.03 0.0309
Schistosoma mansoni intermediate filament proteins 0.0029 0.01 0.0094
Echinococcus granulosus survival motor neuron protein 1 0.0251 0.1473 0.3485
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0035 0.0138 0.1297
Brugia malayi AMP-binding enzyme family protein 0.0049 0.0228 0.0843
Leishmania major 4-coumarate:coa ligase-like protein 0.0049 0.0228 0.9455
Echinococcus granulosus lamin 0.0029 0.01 0.0218
Trypanosoma brucei protein kinase, putative 0.0051 0.024 1
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0015 0.0012 0.0117
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0021 0.0034
Schistosoma mansoni tar DNA-binding protein 0.0061 0.03 0.0309
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0318 0.1221
Echinococcus multilocularis mitogen activated protein kinase 3 0.0051 0.024 0.0232
Entamoeba histolytica hypothetical protein 0.0112 0.0612 0.2349
Entamoeba histolytica glycogenphosphorylase, putative 0.0185 0.1065 0.4125
Onchocerca volvulus Glycogen phosphorylase homolog 0.0429 0.2565 1
Brugia malayi hypothetical protein 0.0035 0.0141 0.0504
Loa Loa (eye worm) intermediate filament protein 0.0029 0.01 0.037
Loa Loa (eye worm) hypothetical protein 0.0049 0.0228 0.0869
Brugia malayi AMP-binding enzyme family protein 0.0049 0.0228 0.0843
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0114 0.4469
Schistosoma mansoni hypothetical protein 0.018 0.1034 0.1095
Leishmania major 4-coumarate:coa ligase-like protein 0.0049 0.0228 0.9455
Schistosoma mansoni hypothetical protein 0.0016 0.0021 0.0009
Onchocerca volvulus 0.0019 0.0038 0.0099
Brugia malayi MAP kinase sur-1 0.0051 0.024 0.0891
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0154 0.0152
Toxoplasma gondii mitochondrial inner membrane translocase subunit TIM17, putative 0.0039 0.0164 0.6679
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0215 0.0207
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0018 0.0049
Brugia malayi Mitochondrial import inner membrane translocase subunit Tim17 family protein 0.0039 0.0164 0.0595
Plasmodium falciparum mitochondrial import inner membrane translocase subunit TIM10, putative 0.0046 0.0207 1
Plasmodium vivax mitochondrial import inner membrane translocase subunit TIM10, putative 0.0046 0.0207 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0049 0.0228 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0037 0.0151 0.1413
Loa Loa (eye worm) hypothetical protein 0.0037 0.0151 0.0568
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0015 0.0012 0.0117
Echinococcus multilocularis tumor protein p63 0.0696 0.4211 0.4207
Loa Loa (eye worm) hypothetical protein 0.0028 0.0097 0.0357
Echinococcus granulosus tar DNA binding protein 0.0061 0.03 0.0695
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.1528 0.9341 1
Onchocerca volvulus 0.0051 0.0239 0.0888
Echinococcus multilocularis GPCR, family 2 0.0016 0.0021 0.0013
Loa Loa (eye worm) hypothetical protein 0.0053 0.0251 0.0959
Entamoeba histolytica hypothetical protein 0.0112 0.0612 0.2349
Brugia malayi intermediate filament protein 0.0029 0.01 0.0342
Brugia malayi hypothetical protein 0.0251 0.1473 0.5722
Mycobacterium ulcerans acyl-CoA synthetase 0.0049 0.0228 0.1398
Echinococcus multilocularis Glycosyl transferase, family 35 0.0429 0.2565 0.2559
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0215 0.0217
Toxoplasma gondii TIM10 family protein, putative 0.0046 0.0207 0.8566
Echinococcus multilocularis peregrin 0.0031 0.0114 0.0106
Loa Loa (eye worm) hypothetical protein 0.0037 0.0151 0.0568
Brugia malayi TAR-binding protein 0.0061 0.03 0.1127
Leishmania major 4-coumarate:coa ligase-like protein 0.0049 0.0228 0.9455
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0021 0.003
Brugia malayi AMP-binding enzyme family protein 0.0049 0.0228 0.0843
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0215 0.0491
Trichomonas vaginalis glycogen phosphorylase, putative 0.0429 0.2565 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0049 0.0228 0.2136
Brugia malayi Mitochondrial import inner membrane translocase subunit Tim17 family protein 0.0039 0.0164 0.0595
Plasmodium falciparum acyl-CoA synthetase 0.0037 0.0151 0.7088
Schistosoma mansoni mitochondrial import inner membrane translocase subunit tim10 0.0046 0.0207 0.0209
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0114 0.0109
Loa Loa (eye worm) hypothetical protein 0.0034 0.0135 0.0507
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0035 0.0138 0.1297
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0215 0.0819
Loa Loa (eye worm) transport to inner mitochondrial membrane family member 0.0046 0.0207 0.079
Echinococcus granulosus intermediate filament protein 0.0029 0.01 0.0218
Schistosoma mansoni jumonji domain containing protein 0.0081 0.042 0.0437
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.024 0.0891
Echinococcus multilocularis muscleblind protein 1 0.0149 0.084 0.0832
Entamoeba histolytica acyl-coA synthetase, putative 0.0049 0.0228 0.0843
Entamoeba histolytica hypothetical protein 0.0112 0.0612 0.2349
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0051 0.024 1
Schistosoma mansoni glycogen phosphorylase 0.0429 0.2565 0.2737
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0049 0.0228 0.1398
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0015 0.0012 0.0029
Loa Loa (eye worm) glutaminase 0.0264 0.1551 0.6038
Brugia malayi Mitochondrial import inner membrane translocase subunit TIM10 0.0046 0.0207 0.0764
Schistosoma mansoni lamin 0.0029 0.01 0.0094
Loa Loa (eye worm) glutaminase 2 0.0264 0.1551 0.6038
Brugia malayi carbohydrate phosphorylase 0.0429 0.2565 1
Echinococcus multilocularis mitogen activated protein kinase 0.0051 0.024 0.0232
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0189 0.043
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0015 0.0012 0.0117
Mycobacterium tuberculosis Probable glycogen phosphorylase GlgP 0.0185 0.1065 1
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0114 0.0426
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0015 0.0012 0.0004
Loa Loa (eye worm) hypothetical protein 0.0031 0.0114 0.0426
Loa Loa (eye worm) hypothetical protein 0.0149 0.084 0.326
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0215 0.0793
Brugia malayi PHD-finger family protein 0.0031 0.0114 0.0398
Schistosoma mansoni tar DNA-binding protein 0.0061 0.03 0.0309
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0049 0.0228 0.2136
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0233 0.0864
Brugia malayi Bromodomain containing protein 0.0031 0.0114 0.0398
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0015 0.0012 0.0117
Echinococcus multilocularis muscleblind protein 0.0149 0.084 0.0832
Schistosoma mansoni hypothetical protein 0.0039 0.0164 0.0163
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0051 0.0239 0.0888
Onchocerca volvulus Alhambra homolog 0.0031 0.0114 0.0398
Mycobacterium ulcerans hypothetical protein 0.0049 0.0228 0.1398
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0049 0.0228 0.1398
Trichomonas vaginalis glutaminase, putative 0.0264 0.1551 0.6027
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0114 0.5217
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0015 0.0012 0.0029
Entamoeba histolytica glycogen phosphorylase, putative 0.0185 0.1065 0.4125
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0015 0.0012 0.0117
Echinococcus multilocularis survival motor neuron protein 1 0.0251 0.1473 0.1466
Echinococcus multilocularis tar DNA binding protein 0.0061 0.03 0.0292
Echinococcus granulosus mitogen activated protein kinase 0.0051 0.024 0.0551
Schistosoma mansoni hypothetical protein 0.0016 0.0021 0.0009
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0037 0.0151 0.0898
Schistosoma mansoni transcription factor LCR-F1 0.0112 0.0612 0.0643
Loa Loa (eye worm) hypothetical protein 0.0029 0.01 0.037
Mycobacterium ulcerans acyl-CoA synthetase 0.0049 0.0228 0.1398
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0112 0.0612 0.1437
Echinococcus multilocularis glycogen phosphorylase 0.0429 0.2565 0.2559
Echinococcus granulosus peregrin 0.0031 0.0114 0.0252
Plasmodium falciparum phd finger protein, putative 0.0031 0.0114 0.5217
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0114 0.0252
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0018 0.0021
Plasmodium vivax mitochondrial import inner membrane translocase subunit TIM23, putative 0.0039 0.0164 0.7797
Loa Loa (eye worm) glycogen phosphorylase 0.0429 0.2565 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0215 0.0491
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0015 0.0012 0.0117
Echinococcus granulosus tumor protein p63 0.0696 0.4211 1
Entamoeba histolytica glycogen phosphorylase, putative 0.0429 0.2565 1
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0051 0.024 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0051 0.024 0.0551
Mycobacterium ulcerans glutaminase 0.0264 0.1551 1
Loa Loa (eye worm) hypothetical protein 0.0149 0.084 0.326
Echinococcus multilocularis geminin 0.018 0.1034 0.1026
Brugia malayi hypothetical protein 0.0035 0.0141 0.0504
Entamoeba histolytica acyl-CoA synthetase, putative 0.0049 0.0228 0.0843
Loa Loa (eye worm) hypothetical protein 0.0049 0.0228 0.0869
Schistosoma mansoni lamin 0.0029 0.01 0.0094
Trichomonas vaginalis glycogen phosphorylase, putative 0.0429 0.2565 1
Schistosoma mansoni glutaminase 0.0264 0.1551 0.1649
Echinococcus multilocularis musashi 0.0029 0.01 0.0092
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0021 0.0063
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0114 0.4469
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0215 0.0207
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0015 0.0012 0.0117
Giardia lamblia Kinase, CMGC MAPK 0.0051 0.024 0.0513
Loa Loa (eye worm) hypothetical protein 0.005 0.0233 0.0891
Entamoeba histolytica glycogen phosphorylase, putative 0.0185 0.1065 0.4125
Brugia malayi Mitochondrial import inner membrane translocase subunit Tim17 family protein 0.0039 0.0164 0.0595
Loa Loa (eye worm) hypothetical protein 0.0039 0.0164 0.0622
Loa Loa (eye worm) jmjC domain-containing protein 0.0038 0.0154 0.0583
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0102 0.0549 0.0541
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0035 0.0138 0.1297
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0035 0.0138 0.1297
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0051 0.024 1
Brugia malayi Muscleblind-like protein 0.0149 0.084 0.324
Mycobacterium ulcerans acyl-CoA synthetase 0.0049 0.0228 0.1398
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0051 0.024 1
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0189 0.0181

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 0.0027 nM Inhibition of HIV1 protease ChEMBL. 21194227

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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