Detailed information for compound 1406120

Basic information

Technical information
  • TDR Targets ID: 1406120
  • Name: 1-(phenylmethyl)-4-[(1S)-1-phenyl-2-phenylsul fanylethyl]-1,4-diazepan-5-one
  • MW: 416.578 | Formula: C26H28N2OS
  • H donors: 0 H acceptors: 1 LogP: 4.7 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CCN(CCN1[C@@H](c1ccccc1)CSc1ccccc1)Cc1ccccc1
  • InChi: 1S/C26H28N2OS/c29-26-16-17-27(20-22-10-4-1-5-11-22)18-19-28(26)25(23-12-6-2-7-13-23)21-30-24-14-8-3-9-15-24/h1-15,25H,16-21H2/t25-/m1/s1
  • InChiKey: LHYOTEUXPODRMQ-RUZDIDTESA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(phenylmethyl)-4-[(1S)-1-phenyl-2-phenylsulfanyl-ethyl]-1,4-diazepan-5-one
  • 1-(phenylmethyl)-4-[(1S)-1-phenyl-2-(phenylthio)ethyl]-1,4-diazepan-5-one
  • 1-(benzyl)-4-[(1S)-1-phenyl-2-(phenylthio)ethyl]-1,4-diazepan-5-one

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No 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
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis set domain proteins, putative 0.0271 0.4826 1
Echinococcus multilocularis serotonin receptor 0.0019 0.0064 0.0023
Onchocerca volvulus 0.0019 0.0064 0.0037
Schistosoma mansoni neuropeptide F-like receptor 0.0019 0.0064 0.0037
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Onchocerca volvulus 0.0065 0.0937 0.1468
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0038 0.0431 0.0404
Plasmodium falciparum calcium-dependent protein kinase 5 0.0038 0.0431 0.0404
Loa Loa (eye worm) hypothetical protein 0.0028 0.0235 0.0255
Schistosoma mansoni hypothetical protein 0.0019 0.0064 0.0037
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Echinococcus granulosus geminin 0.0205 0.3567 0.354
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Brugia malayi Pre-SET motif family protein 0.0239 0.4205 0.4525
Loa Loa (eye worm) sugar transporter 0.0125 0.2063 0.2232
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Leishmania major glucose transporter, lmgt1 0.0039 0.044 0.445
Leishmania major glucose transporter, lmgt3 0.0039 0.044 0.445
Echinococcus granulosus 7TM GPCR rhodopsin 0.0019 0.0064 0.0023
Schistosoma mansoni neuropeptide f receptor 76f 0.0019 0.0064 0.0037
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Mycobacterium tuberculosis Probable conserved integral membrane transport protein 0.0065 0.0937 1
Echinococcus granulosus g protein coupled receptor 0.0019 0.0064 0.0023
Brugia malayi lysyl-tRNA synthetase 0.0028 0.0235 0.0211
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0019 0.0064 0.0023
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0019 0.0064 0.0069
Echinococcus granulosus tm gpcr rhodopsin 0.0019 0.0064 0.0023
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0019 0.0064 0.0023
Schistosoma mansoni adenoreceptor 0.0019 0.0064 0.0037
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0038 0.0431 0.7919
Echinococcus multilocularis fmrfamide receptor 0.0019 0.0064 0.0023
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0341 0.6145 0.6129
Schistosoma mansoni hypothetical protein 0.0205 0.3567 0.5776
Entamoeba histolytica sodium/proton antiporter, putative 0.0065 0.0937 1
Schistosoma mansoni glucose transport protein 0.0125 0.2063 0.3313
Schistosoma mansoni lysyl-tRNA synthetase 0.0028 0.0235 0.0318
Brugia malayi sulfakinin receptor protein 0.0506 0.9244 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0038 0.0431 0.0617
Schistosoma mansoni neuropeptide receptor 0.0019 0.0064 0.0037
Toxoplasma gondii sodium/hydrogen exchanger NHE2 0.0065 0.0937 0.1419
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0051 0.001
Echinococcus granulosus orexin receptor type 2 0.0019 0.0064 0.0023
Toxoplasma gondii Na+/H+ exchanger NHE3 0.0065 0.0937 0.1419
Schistosoma mansoni biogenic amine receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0038 0.0431 0.0466
Brugia malayi G protein-coupled receptor F59B2.13 0.0019 0.0064 0.0025
Schistosoma mansoni neuropeptide receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0019 0.0064 0.0023
Schistosoma mansoni opsin-like receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) sodium-hydrogen exchanger NHE1 0.0065 0.0937 0.1014
Brugia malayi hypothetical protein 0.0506 0.9244 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0037 0.0416 0.0408
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Echinococcus granulosus hypothetical protein 0.0019 0.0064 0.0023
Onchocerca volvulus 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni hypothetical protein 0.0205 0.3567 0.5776
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0341 0.6145 0.6648
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0037 0.0416 0.0614
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0341 0.6145 1
Brugia malayi Cam kinase protein 1 0.0038 0.0431 0.0423
Loa Loa (eye worm) hypothetical protein 0.0018 0.0051 0.0055
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Onchocerca volvulus 0.0019 0.0064 0.0037
Giardia lamblia Prolyl-tRNA synthetase 0.0037 0.0416 0.0614
Brugia malayi hypothetical protein 0.0065 0.0937 0.0974
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0341 0.6145 1
Schistosoma mansoni hypothetical protein 0.0065 0.0937 0.1468
Loa Loa (eye worm) hypothetical protein 0.0506 0.9244 1
Giardia lamblia Lysyl-tRNA synthetase 0.0028 0.0235 0.0318
Brugia malayi Dopamine receptor protein 2 0.0019 0.0064 0.0025
Echinococcus multilocularis G protein coupled receptor 139 0.0019 0.0064 0.0023
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0019 0.0064 0.0025
Schistosoma mansoni sodium/hydrogen exchanger 2 (nhe2) 0.0341 0.6145 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0355 0.0514
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0019 0.0064 0.0023
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.044 0.0834
Echinococcus granulosus neuropeptide receptor 0.0019 0.0064 0.0023
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Trypanosoma cruzi hexose transporter, putative 0.0039 0.044 0.445
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0355 0.0497
Brugia malayi Serotonin receptor 0.0019 0.0064 0.0025
Schistosoma mansoni alpha-1 adrenergic receptor 0.0019 0.0064 0.0037
Echinococcus multilocularis G-protein coupled receptor, putative 0.0019 0.0064 0.0023
Leishmania major protein kinase, putative 0.0038 0.0431 0.4347
Trichomonas vaginalis glucose transporter, putative 0.0039 0.044 0.0834
Echinococcus granulosus dro:myosuppressin receptor 0.0019 0.0064 0.0023
Brugia malayi Cytochrome P450 family protein 0.0073 0.1085 0.1134
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0019 0.0064 0.0025
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.044 0.8107
Echinococcus granulosus neuropeptide Y receptor 0.0019 0.0064 0.0023
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0019 0.0064 0.0023
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0028 0.0235 0.1013
Loa Loa (eye worm) hypothetical protein 0.0038 0.0431 0.0466
Echinococcus granulosus calcium dependent protein kinase 0.0036 0.0386 0.0347
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Brugia malayi GnHR receptor homolog 0.0019 0.0064 0.0025
Echinococcus granulosus sodium:hydrogen exchanger 7 0.0065 0.0937 0.09
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0533 1
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0044 0.0533 0.0779
Plasmodium vivax SET domain protein, putative 0.0034 0.0355 0.0325
Schistosoma mansoni amine GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) G-protein coupled receptor 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0019 0.0064 0.0037
Brugia malayi RE15519p 0.0019 0.0064 0.0025
Brugia malayi Dopamine receptor protein 1 0.0019 0.0064 0.0025
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.044 0.8107
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Schistosoma mansoni glucose transport protein 0.0125 0.2063 0.3313
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0038 0.0431 0.0423
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0019 0.0064 0.0023
Echinococcus multilocularis neuropeptide Y receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis calcium dependent protein kinase 0.0036 0.0386 0.0347
Echinococcus granulosus neuropeptides capa receptor 0.0019 0.0064 0.0023
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0125 0.2063 0.2031
Loa Loa (eye worm) hypothetical protein 0.0037 0.0416 0.045
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Schistosoma mansoni amine GPCR 0.0019 0.0064 0.0037
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis sodium:hydrogen exchanger 0.0341 0.6145 0.6129
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0038 0.0431 0.0466
Loa Loa (eye worm) hypothetical protein 0.0065 0.0937 0.1014
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0037 0.0416 0.3327
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus granulosus 7tm_1 domain containing protein 0.0019 0.0064 0.0023
Schistosoma mansoni hypothetical protein 0.0065 0.0937 0.1468
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0037 0.0416 0.0377
Echinococcus multilocularis lysyl tRNA synthetase 0.0028 0.0235 0.0195
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0341 0.6145 0.6129
Echinococcus multilocularis serotonin receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0065 0.0937 0.1014
Onchocerca volvulus 0.0065 0.0937 0.1468
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0044 0.0533 0.549
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0019 0.0064 0.0037
Trichomonas vaginalis CAMK family protein kinase 0.0038 0.0431 0.0814
Echinococcus multilocularis neuropeptide receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Mycobacterium tuberculosis Probable conserved integral membrane transport protein YjcE 0.0065 0.0937 1
Plasmodium vivax lysine--tRNA ligase, putative 0.0028 0.0235 0.0201
Echinococcus granulosus sodium:hydrogen exchanger 0.0341 0.6145 0.6129
Echinococcus multilocularis orexin receptor type 2 0.0019 0.0064 0.0023
Entamoeba histolytica protein kinase, putative 0.0038 0.0431 0.2782
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0051 0.0011
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus multilocularis somatostatin receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis neuropeptides capa receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis sodium:hydrogen exchanger 7 0.0065 0.0937 0.09
Plasmodium vivax calcium-dependent protein kinase, putative 0.0038 0.0431 0.0404
Schistosoma mansoni biogenic amine receptor 0.0019 0.0064 0.0037
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Echinococcus multilocularis neuropeptide receptor 0.0019 0.0064 0.0023
Echinococcus granulosus g-protein coupled receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0064 0.0023
Trypanosoma cruzi Na/H antiporter-like protein, putative 0.0065 0.0937 1
Mycobacterium ulcerans potassium/proton antiporter 0.0065 0.0937 1
Schistosoma mansoni hypothetical protein 0.0019 0.0064 0.0037
Toxoplasma gondii protein kinase, putative 0.0353 0.6359 1
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0028 0.0235 0.2168
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0019 0.0064 0.0069
Schistosoma mansoni opsin-like receptor 0.0019 0.0064 0.0037
Trichomonas vaginalis sugar transporter, putative 0.0039 0.044 0.0834
Loa Loa (eye worm) melatonin receptor type 1A 0.0019 0.0064 0.0069
Brugia malayi putative neuropeptide receptor 0.0019 0.0064 0.0025
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0019 0.0064 0.0037
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0028 0.0235 0.2168
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0019 0.0064 0.0025
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0024 0.0156 0.1285
Schistosoma mansoni neuropeptide receptor 0.0019 0.0064 0.0037
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0355 0.0315
Echinococcus granulosus g protein coupled receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) TYRA-2 protein 0.0019 0.0064 0.0069
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Plasmodium falciparum calcium-dependent protein kinase 2 0.0038 0.0431 0.0404
Echinococcus granulosus peptide allatostatin:somatostatin 0.0019 0.0064 0.0023
Schistosoma mansoni opsin-like receptor 0.0019 0.0064 0.0037
Leishmania major glucose transporter/membrane transporter D2, putative 0.0039 0.044 0.445
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0057 0.0787 0.0851
Echinococcus granulosus allatostatin A receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) sodium/hydrogen exchanger 0.0341 0.6145 0.6648
Schistosoma mansoni biogenic amine (5HT) receptor 0.0019 0.0064 0.0037
Schistosoma mansoni histamine h1 receptor 0.0019 0.0064 0.0037
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0331 0.0291
Onchocerca volvulus 0.0019 0.0064 0.0037
Onchocerca volvulus 0.0019 0.0064 0.0037
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus granulosus biogenic amine 5HT receptor 0.0019 0.0064 0.0023
Echinococcus granulosus neuropeptide Y receptor 0.0019 0.0064 0.0023
Schistosoma mansoni growth hormone secretagogue receptor 0.0019 0.0064 0.0037
Brugia malayi Pre-SET motif family protein 0.0034 0.0355 0.0341
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0341 0.6145 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Onchocerca volvulus 0.0019 0.0064 0.0037
Loa Loa (eye worm) NHE-3 0.0341 0.6145 0.6648
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Entamoeba histolytica protein kinase, putative 0.0038 0.0431 0.2782
Loa Loa (eye worm) sugar transporter 0.0018 0.0041 0.0044
Plasmodium falciparum protein kinase 6 0.053 0.9698 1
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0341 0.6145 0.6129
Onchocerca volvulus 0.0034 0.0355 0.0514
Brugia malayi AKH receptor 0.0019 0.0064 0.0025
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0028 0.0235 0.0406
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni serine/threonine protein kinase 0.0038 0.0431 0.0638
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Brugia malayi neuropeptide F receptor 0.0019 0.0064 0.0025
Trichomonas vaginalis sugar transporter, putative 0.0039 0.044 0.0834
Echinococcus granulosus neuropeptides capa receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis allatostatin A receptor 0.0019 0.0064 0.0023
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Echinococcus granulosus sodium:hydrogen exchanger 2 (nhe2) 0.0276 0.4918 0.4897
Plasmodium falciparum lysine--tRNA ligase 0.0028 0.0235 0.0201
Schistosoma mansoni myosin xvIII 0.0019 0.0064 0.0037
Schistosoma mansoni sodium/hydrogen exchanger 3 (nhe3) 0.0065 0.0937 0.1468
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0019 0.0064 0.0037
Echinococcus granulosus mitochondrial sodium:hydrogen exchanger 9B2 0.0065 0.0937 0.09
Schistosoma mansoni amine GPCR 0.0019 0.0064 0.0037
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0064 0.0037
Echinococcus multilocularis g-protein coupled receptor 0.0019 0.0064 0.0023
Toxoplasma gondii Na+/H+ exchanger NHE1 0.0065 0.0937 0.1419
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Echinococcus multilocularis sodium:hydrogen exchanger 0.0341 0.6145 0.6129
Plasmodium falciparum sodium/hydrogen exchanger, Na+, H+ antiporter 0.0065 0.0937 0.0928
Leishmania major hypothetical protein, conserved 0.0065 0.0937 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.0787 0.081
Schistosoma mansoni hypothetical protein 0.0019 0.0064 0.0037
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0019 0.0064 0.0023
Brugia malayi Sugar transporter family protein 0.0125 0.2063 0.2198
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0276 0.4918 0.4897
Plasmodium vivax proline--tRNA ligase, putative 0.0044 0.0533 0.051
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0019 0.0064 0.0069
Leishmania major Na/H antiporter-like protein 0.0065 0.0937 1
Echinococcus multilocularis mitochondrial sodium:hydrogen exchanger 9B2 0.0065 0.0937 0.09
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Plasmodium falciparum calcium-dependent protein kinase 1 0.0038 0.0431 0.0404
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni hypothetical protein 0.0018 0.0051 0.0016
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Wolbachia endosymbiont of Brugia malayi Kef-type K+ transport system, membrane component 0.0065 0.0937 1
Schistosoma mansoni amine GPCR 0.0019 0.0064 0.0037
Plasmodium falciparum protein kinase 7 0.0353 0.6359 0.6542
Brugia malayi MH2 domain containing protein 0.0144 0.2427 0.2593
Plasmodium falciparum calcium-dependent protein kinase 4 0.0038 0.0431 0.0404
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Leishmania major glucose transporter, lmgt2 0.0039 0.044 0.445
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0341 0.6145 0.6648
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0064 0.0023
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0019 0.0064 0.0023
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0341 0.6145 0.6129
Onchocerca volvulus 0.0019 0.0064 0.0037
Schistosoma mansoni neuropeptide receptor 0.0019 0.0064 0.0037
Onchocerca volvulus 0.0019 0.0064 0.0037
Brugia malayi Tachykinin-like peptides receptor 99D 0.0019 0.0064 0.0025
Plasmodium falciparum calcium-dependent protein kinase 3 0.0038 0.0431 0.0404
Echinococcus multilocularis neuropeptide FF receptor 2 0.0019 0.0064 0.0023
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0064 0.0037
Trichomonas vaginalis sugar transporter, putative 0.0039 0.044 0.0834
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0533 0.549
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0051 0.001
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0446 0.044
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0037 0.0416 0.0784
Trypanosoma cruzi hexose transporter, putative 0.0021 0.0109 0.0759
Toxoplasma gondii sodium/hydrogen exchanger 3 protein 0.0065 0.0937 0.1419
Brugia malayi Serotonin receptor 0.0019 0.0064 0.0025
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0019 0.0064 0.0023
Loa Loa (eye worm) major facilitator superfamily transporter 0.0018 0.0041 0.0044
Trypanosoma brucei glucose transporter 2A 0.0039 0.044 0.8107
Echinococcus granulosus tm gpcr rhodopsin 0.0019 0.0064 0.0023
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0341 0.6145 0.6129
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Schistosoma mansoni protein kinase 0.0038 0.0431 0.0638
Onchocerca volvulus 0.0019 0.0064 0.0037
Brugia malayi Dopamine receptor 0.0019 0.0064 0.0025
Trypanosoma cruzi Na/H antiporter-like protein, putative 0.0065 0.0937 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0019 0.0064 0.0023
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Loa Loa (eye worm) neuropeptide F receptor 0.0019 0.0064 0.0069
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Mycobacterium leprae probable conserved integral membrane transport protein 0.0065 0.0937 1
Giardia lamblia Sodium/hydrogen exchanger 3 0.0341 0.6145 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0073 0.1085 0.1174
Trichomonas vaginalis glucose transporter, putative 0.0039 0.044 0.0834
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Onchocerca volvulus 0.0019 0.0064 0.0037
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0024 0.0156 0.1285
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0038 0.0431 0.0391
Chlamydia trachomatis lysine--tRNA ligase 0.0028 0.0235 0.5
Schistosoma mansoni biogenic amine receptor 0.0019 0.0064 0.0037
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0019 0.0064 0.0023
Schistosoma mansoni Slc9a7 protein 0.0065 0.0937 0.1468
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0051 0.0055
Echinococcus granulosus tm gpcr rhodopsin 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0037 0.0416 0.045
Echinococcus multilocularis geminin 0.0205 0.3567 0.354
Loa Loa (eye worm) G-protein coupled receptor 0.0019 0.0064 0.0069
Onchocerca volvulus Neuropeptide F receptor homolog 0.0019 0.0064 0.0037
Echinococcus multilocularis General substrate transporter 0.0107 0.1733 0.1698
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0202 0.3513 0.5495
Brugia malayi sodium/hydrogen exchanger 3 family protein 0.0341 0.6145 0.6633
Loa Loa (eye worm) sodium/hydrogen exchanger 3 family protein 0.0341 0.6145 0.6648
Brugia malayi larval opioid receptor 0.0019 0.0064 0.0025
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0019 0.0064 0.0069
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0019 0.0064 0.0037
Toxoplasma gondii facilitative glucose transporter GT1 0.0125 0.2063 0.3201
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Brugia malayi neuropeptide F receptor 0.0019 0.0064 0.0025
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.2427 0.2626
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Plasmodium vivax CDK-related protein kinase 6, putative 0.053 0.9698 1
Loa Loa (eye worm) hypothetical protein 0.0341 0.6145 0.6648
Schistosoma mansoni glucose transport protein 0.0125 0.2063 0.3313
Echinococcus granulosus neuropeptide receptor 0.0019 0.0064 0.0023
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0355 0.0514
Echinococcus multilocularis sex peptide receptor 0.0019 0.0064 0.0023
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0355 0.0514
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Schistosoma mansoni sodium/hydrogen exchanger 0.0341 0.6145 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.0787 0.0851
Schistosoma mansoni biogenic amine (5HT) receptor 0.0019 0.0064 0.0037
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Brugia malayi G protein-coupled receptor 0.0019 0.0064 0.0025
Schistosoma mansoni lysyl-tRNA synthetase 0.0028 0.0235 0.0318
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0019 0.0064 0.0023
Trypanosoma brucei glucose transporter 1E 0.0039 0.044 0.8107
Echinococcus granulosus serotonin receptor 0.0019 0.0064 0.0023
Onchocerca volvulus 0.0271 0.4826 0.7839
Echinococcus granulosus g protein coupled receptor 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0019 0.0064 0.0023
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0037 0.0416 0.0408
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0051 0.0011
Echinococcus granulosus somatostatin receptor 0.0019 0.0064 0.0023
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0028 0.0235 0.395
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Schistosoma mansoni hypothetical protein 0.0039 0.0446 0.0664
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0355 0.0315
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0037 0.0416 0.0377
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Brugia malayi Sodium/hydrogen exchanger 8 0.0065 0.0937 0.0974
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Echinococcus multilocularis GPCR, family 2 0.0018 0.0051 0.001
Echinococcus granulosus biogenic amine 5HT receptor 0.0019 0.0064 0.0023
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Entamoeba histolytica sodium/proton antiporter, putative 0.0065 0.0937 1
Echinococcus granulosus sodium:hydrogen exchanger 0.0341 0.6145 0.6129
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Mycobacterium ulcerans membrane transporter 0.0065 0.0937 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni hypothetical protein 0.0018 0.0051 0.0016
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0038 0.0431 0.0404
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.2427 0.2626
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0038 0.0431 0.0617
Onchocerca volvulus 0.0019 0.0064 0.0037
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0019 0.0064 0.0069
Echinococcus multilocularis neuropeptide Y receptor 0.0019 0.0064 0.0023
Schistosoma mansoni protein kinase 0.0038 0.0431 0.0638
Onchocerca volvulus 0.0019 0.0064 0.0037
Echinococcus granulosus General substrate transporter 0.0107 0.1733 0.1698
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0019 0.0064 0.0037
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0019 0.0064 0.0025
Onchocerca volvulus 0.0019 0.0064 0.0037
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0019 0.0064 0.0037
Loa Loa (eye worm) major facilitator superfamily transporter 0.0018 0.0041 0.0044
Trypanosoma cruzi sodium/hydrogen exchanger, putative 0.0065 0.0937 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0034 0.0355 0.0384
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Echinococcus granulosus GPCR family 2 0.0018 0.0051 0.001
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0028 0.0235 0.2168
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Trypanosoma cruzi hexose transporter, putative 0.0039 0.044 0.445
Echinococcus granulosus G protein coupled receptor 139 0.0019 0.0064 0.0023
Echinococcus granulosus sex peptide receptor 0.0019 0.0064 0.0023
Brugia malayi G-protein coupled receptor 0.0019 0.0064 0.0025
Echinococcus multilocularis dro:myosuppressin receptor 0.0019 0.0064 0.0023
Brugia malayi Melatonin receptor type 1A 0.0019 0.0064 0.0025
Brugia malayi sodium/hydrogen exchanger 3 family protein 0.0065 0.0937 0.0974
Echinococcus granulosus lysyl tRNA synthetase 0.0028 0.0235 0.0195
Loa Loa (eye worm) neuropeptide F receptor 0.0019 0.0064 0.0069
Brugia malayi ORL1-like opioid receptor 0.0019 0.0064 0.0025
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Schistosoma mansoni hypothetical protein 0.0018 0.0051 0.0016
Schistosoma mansoni hypothetical protein 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.044 0.8107
Plasmodium falciparum proline--tRNA ligase 0.0044 0.0533 0.051
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0064 0.0037
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0019 0.0064 0.0023
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.0787 0.081
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni neuropeptide F-like receptor 0.0019 0.0064 0.0037
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Trypanosoma cruzi sodium/hydrogen exchanger, putative 0.0065 0.0937 1
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Trypanosoma brucei glucose transporter, putative 0.0039 0.044 0.8107
Mycobacterium ulcerans ion antiporter, NhaP 0.0065 0.0937 1
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.0171 0.0271
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0038 0.0431 0.0404
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0038 0.0431 0.0617
Echinococcus granulosus tachykinin peptides receptor 99D 0.0019 0.0064 0.0023
Onchocerca volvulus 0.0019 0.0064 0.0037
Echinococcus granulosus neuropeptide FF receptor 2 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.003 0.0284 0.0307
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0533 0.549
Echinococcus multilocularis fmrfamide receptor 0.0019 0.0064 0.0023
Plasmodium falciparum hexose transporter 0.0125 0.2063 0.2094
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0037 0.0416 0.0614
Schistosoma mansoni hypothetical protein 0.0125 0.2063 0.3313
Brugia malayi follicle stimulating hormone receptor 0.0019 0.0064 0.0025
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0341 0.6145 0.6129
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0202 0.3513 0.3595
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0019 0.0064 0.0023
Leishmania major lysyl-tRNA synthetase, putative 0.0028 0.0235 0.2168
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0051 0.001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0019 0.0064 0.0023
Echinococcus granulosus fmrfamide receptor 0.0019 0.0064 0.0023
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0019 0.0064 0.0037
Onchocerca volvulus 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni hypothetical protein 0.0018 0.0051 0.0016
Schistosoma mansoni protein kinase 0.0038 0.0431 0.0638
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0125 0.2063 0.2031
Onchocerca volvulus 0.0019 0.0064 0.0037
Plasmodium vivax hexose transporter 0.0125 0.2063 0.2094
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0019 0.0064 0.0025
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0038 0.0431 0.0391
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Brugia malayi hypothetical protein 0.0019 0.0064 0.0025
Onchocerca volvulus 0.0019 0.0064 0.0037
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.044 0.0834
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0039 0.0446 0.0483
Echinococcus multilocularis neuropeptides capa receptor 0.0019 0.0064 0.0023
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0019 0.0064 0.0037
Trypanosoma cruzi hexose transporter 0.0039 0.044 0.445
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Schistosoma mansoni amine GPCR 0.0019 0.0064 0.0037
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0239 0.4205 0.4549
Toxoplasma gondii lysine-tRNA ligase 0.0028 0.0235 0.0308
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0051 0.001
Brugia malayi putative neuropeptide receptor NPR1 0.0019 0.0064 0.0025
Brugia malayi G-protein coupled receptor 0.0019 0.0064 0.0025
Loa Loa (eye worm) hypothetical protein 0.0018 0.0041 0.0044
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0019 0.0064 0.0023
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Plasmodium falciparum mitogen-activated protein kinase 2 0.0202 0.3513 0.3595
Trypanosoma cruzi hexose transporter, putative 0.0039 0.044 0.445
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0355 0.0514
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0037 0.0416 0.2574
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0064 0.0069
Plasmodium vivax sodium/hydrogen exchanger 1, putative 0.0065 0.0937 0.0928
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0355 0.0315
Trichomonas vaginalis conserved hypothetical protein 0.0125 0.2063 0.4226
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0044 0.0533 0.549

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.1312 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 1.0323 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 14.7157 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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