Detailed information for compound 1393544

Basic information

Technical information
  • TDR Targets ID: 1393544
  • Name: 2-furan-2-yl-1-(4-methylphenyl)-4-oxo-6-sulfa nyl-2,3-dihydropyrimidine-5-carbonitrile
  • MW: 311.358 | Formula: C16H13N3O2S
  • H donors: 1 H acceptors: 2 LogP: 2.62 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CC1=C(S)N(C(NC1=O)c1ccco1)c1ccc(cc1)C
  • InChi: 1S/C16H13N3O2S/c1-10-4-6-11(7-5-10)19-14(13-3-2-8-21-13)18-15(20)12(9-17)16(19)22/h2-8,14,22H,1H3,(H,18,20)
  • InChiKey: VFIRJYJMECEAGF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(2-furyl)-1-(4-methylphenyl)-4-oxo-6-sulfanyl-2,3-dihydropyrimidine-5-carbonitrile
  • 2-(2-furyl)-6-mercapto-1-(4-methylphenyl)-4-oxo-2,3-dihydropyrimidine-5-carbonitrile
  • 2-(2-furyl)-4-keto-6-mercapto-1-(4-methylphenyl)-2,3-dihydropyrimidine-5-carbonitrile
  • AF-399/42810488
  • MLS000624573
  • SMR000323527

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania braziliensis trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Giardia lamblia Fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Toxoplasma gondii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Leishmania donovani trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Treponema pallidum fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Loa Loa (eye worm) glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium berghei thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium falciparum thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Neospora caninum Glutathione reductase, related Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma brucei gambiense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Neospora caninum MGC84926 protein, related Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium knowlesi thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Leishmania mexicana trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium berghei glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania major trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Cryptosporidium hominis thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Babesia bovis thiodoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma cruzi trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Cryptosporidium parvum thioredoxin reductase 1 Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi Thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania infantum trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium yoelii glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma congolense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium yoelii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr Get druggable targets OG5_126785 All targets in OG5_126785
Theileria parva thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K00384 thioredoxin reductase (NADPH) [EC1.8.1.9], putative Get druggable targets OG5_126785 All targets in OG5_126785
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Neospora caninum Dihydrolipoyl dehydrogenase (EC 1.8.1.4), related Thioredoxin reductase 1, cytoplasmic   499 aa 464 aa 24.8 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Leishmania donovani acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Leishmania mexicana acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 24.4 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast Thioredoxin reductase 1, cytoplasmic   499 aa 506 aa 23.7 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.3 %
Trypanosoma brucei dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.4 %
Leishmania donovani dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Leishmania braziliensis 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 450 aa 25.6 %
Plasmodium falciparum glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 500 aa 32.2 %
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 454 aa 25.3 %
Leishmania mexicana 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 452 aa 25.7 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 460 aa 25.4 %
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.5 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Mycobacterium ulcerans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 26.9 %
Leishmania braziliensis dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 488 aa 21.9 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 519 aa 23.7 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, point mutation,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.3 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 540 aa 23.3 %
Neospora caninum hypothetical protein Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.0 %
Plasmodium falciparum thioredoxin reductase Thioredoxin reductase 1, cytoplasmic   499 aa 511 aa 45.2 %
Neospora caninum glutathione reductase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 32.7 %
Toxoplasma gondii NADPH-glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 529 aa 31.8 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Plasmodium berghei dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 26.9 %
Leishmania infantum dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.5 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.3 %
Leishmania braziliensis acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 22.8 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.9 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.5 %
Plasmodium berghei dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 539 aa 22.3 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 518 aa 24.9 %
Leishmania infantum acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.2 %
Leishmania major acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.5 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 462 aa 25.8 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.6 %
Onchocerca volvulus Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 57.3 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.2 %
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Giardia lamblia Kinase, STE STE20 0.0158 0.0783 0.4158
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0134 0.0918
Entamoeba histolytica hypothetical protein 0.0152 0.075 0.393
Trypanosoma cruzi cdc2-related kinase 1 0.0147 0.072 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0134 0.0134
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Giardia lamblia Kinase, CMGC GSK 0.0061 0.0234 0.1243
Entamoeba histolytica protein kinase domain containing protein 0.0061 0.0234 0.1168
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0172 0.0863 0.5916
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0065 0.0253 0.3514
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Giardia lamblia Kinase, CMGC GSK 0.0061 0.0234 0.1243
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0065 0.0253 0.3514
Loa Loa (eye worm) thioredoxin reductase 0.0057 0.0211 0.0195
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0061 0.0234 0.0256
Loa Loa (eye worm) hypothetical protein 0.0035 0.0088 0.0072
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0016 0.0085
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0061 0.0234 0.0256
Entamoeba histolytica cell division protein kinase 2, putative 0.0147 0.072 0.3773
Loa Loa (eye worm) STE/STE20/PAKB protein kinase 0.1789 1 1
Echinococcus multilocularis cyclin dependent kinase 0.0147 0.072 0.0788
Brugia malayi beta-lactamase family protein 0.0043 0.0134 0.0134
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0016 0.0185
Echinococcus granulosus serine:threonine protein kinase PAK 4 0.1636 0.9138 1
Loa Loa (eye worm) CAMK/CAMKL/MELK protein kinase 0.0041 0.0121 0.0105
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.02 0.2184
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.02 0.0219
Echinococcus granulosus serine:threonine protein kinase PAK 3 0.0158 0.0783 0.0857
Echinococcus multilocularis mitogen activated protein kinase 3 0.0065 0.0253 0.0277
Mycobacterium tuberculosis Conserved protein 0.0043 0.0134 0.0918
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.0016 0.0109
Giardia lamblia DINP protein human, muc B family 0.0023 0.0016 0.0085
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0253 0.1344
Trypanosoma brucei protein kinase, putative 0.0065 0.0253 0.3514
Loa Loa (eye worm) CAMK/CAMKL/MARK protein kinase 0.0053 0.0187 0.0171
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0134 0.0711
Trichomonas vaginalis STE family protein kinase 0.0158 0.0783 0.4158
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Entamoeba histolytica hypothetical protein 0.0152 0.075 0.393
Plasmodium vivax protein kinase Crk2 0.0147 0.072 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.013 0.0624 0.4282
Plasmodium falciparum thioredoxin reductase 0.0057 0.0211 0.2928
Plasmodium falciparum glutathione reductase 0.0057 0.0211 0.2928
Trypanosoma cruzi cdc2-related kinase 1 0.0147 0.072 1
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0134 0.0711
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0134 0.0711
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0016 0.0221
Schistosoma mansoni serine/threonine protein kinase 0.0152 0.075 0.8172
Echinococcus granulosus serine:threonine protein kinase PAK 3 0.0158 0.0783 0.0857
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0016 0.0017
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Entamoeba histolytica protein kinase, putative 0.0158 0.0783 0.4108
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0147 0.072 1
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0134 0.0918
Giardia lamblia Kinase, CMGC CDK 0.0147 0.072 0.3825
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.013 0.0624 0.4282
Echinococcus granulosus cyclin dependent kinase 5 0.0147 0.072 0.0788
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0016 0.0221
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0134 0.0918
Schistosoma mansoni hypothetical protein 0.0152 0.075 0.8172
Mycobacterium tuberculosis Probable oxidoreductase 0.0145 0.0707 0.4845
Giardia lamblia Kinase, CMGC CDK 0.0147 0.072 0.3825
Trypanosoma cruzi cdc2-related kinase 3 0.0147 0.072 1
Echinococcus granulosus calcium activated potassium channel 0.0041 0.0121 0.0133
Schistosoma mansoni hypothetical protein 0.0035 0.0088 0.0958
Mycobacterium tuberculosis Probable reductase 0.013 0.0624 0.4282
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0134 0.1859
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Brugia malayi MAP kinase sur-1 0.0065 0.0253 0.0253
Echinococcus granulosus mitogen activated protein kinase 3 0.0065 0.0253 0.0277
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Echinococcus granulosus serine:threonine protein kinase 0.0053 0.0187 0.0204
Trichomonas vaginalis STE family protein kinase 0.0158 0.0783 0.4158
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0134 0.0918
Echinococcus granulosus dna polymerase kappa 0.0023 0.0016 0.0017
Entamoeba histolytica cell division protein kinase 2, putative 0.0147 0.072 0.3773
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0055 0.0764
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.002 0 0.5
Schistosoma mansoni protein kinase 0.0152 0.075 0.8172
Mycobacterium tuberculosis Putative ferredoxin reductase 0.013 0.0624 0.4282
Brugia malayi cell division control protein 2 homolog 0.0147 0.072 0.072
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Entamoeba histolytica protein kinase, putative 0.0158 0.0783 0.4108
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0061 0.0234 0.325
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0145 0.0707 0.4845
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0134 0.1552
Schistosoma mansoni serine/threonine protein kinase 0.0147 0.072 0.7852
Brugia malayi Kinase associated domain 1 family protein 0.0035 0.0088 0.0088
Trypanosoma cruzi cdc2-related kinase 3 0.0147 0.072 1
Echinococcus multilocularis neural Wiskott Aldrich syndrome protein 0.0152 0.075 0.0821
Echinococcus granulosus thioredoxin glutathione reductase 0.0057 0.0211 0.0231
Echinococcus granulosus cyclin dependent kinase 0.0147 0.072 0.0788
Schistosoma mansoni serine/threonine kinase 0.0041 0.0121 0.132
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0016 0.0174
Echinococcus granulosus protein kinase shaggy 0.0061 0.0234 0.0256
Brugia malayi Protein kinase domain containing protein 0.0053 0.0187 0.0187
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0134 0.0147
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0134 0.1859
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0172 0.0863 1
Echinococcus granulosus 3'partial|serine:threonine protein kinase PAK 2 0.0152 0.075 0.0821
Schistosoma mansoni serine/threonine protein kinase 0.0041 0.0121 0.132
Echinococcus multilocularis hypothetical protein 0.0035 0.0088 0.0096
Leishmania major hypothetical protein, conserved 0.0043 0.0134 0.1859
Echinococcus multilocularis thioredoxin glutathione reductase 0.0057 0.0211 0.0231
Brugia malayi beta-lactamase family protein 0.0043 0.0134 0.0134
Treponema pallidum fructose-bisphosphate aldolase 0.0353 0.1883 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.02 0.0219
Loa Loa (eye worm) hypothetical protein 0.0141 0.0687 0.0672
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0061 0.0234 0.0219
Loa Loa (eye worm) glutathione reductase 0.0057 0.0211 0.0195
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0016 0.0221
Plasmodium vivax glycogen synthase kinase 3, putative 0.0061 0.0234 0.325
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0065 0.0253 0.0238
Loa Loa (eye worm) hypothetical protein 0.0152 0.075 0.0735
Giardia lamblia Fructose-bisphosphate aldolase 0.0353 0.1883 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.02 0.0219
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0134 0.146
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0253 0.1344
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0134 0.1859
Brugia malayi Protein kinase domain 0.0158 0.0783 0.0783
Brugia malayi Protein kinase domain containing protein 0.0147 0.072 0.072
Trichomonas vaginalis CMGC family protein kinase 0.0061 0.0234 0.1243
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0055 0.0764
Schistosoma mansoni hypothetical protein 0.0152 0.075 0.8172
Trypanosoma brucei unspecified product 0.0023 0.0016 0.0221
Trichomonas vaginalis CMGC family protein kinase 0.0147 0.072 0.3825
Brugia malayi Thioredoxin reductase 0.0057 0.0211 0.0211
Schistosoma mansoni hypothetical protein 0.0152 0.075 0.8172
Schistosoma mansoni serine/threonine protein kinase 0.0041 0.0121 0.132
Echinococcus multilocularis cyclin dependent kinase 5 0.0147 0.072 0.0788
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.013 0.0624 0.4282
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0134 0.0918
Schistosoma mansoni protein kinase 0.0158 0.0783 0.8534
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Echinococcus multilocularis serine:threonine protein kinase PAK 3 0.0158 0.0783 0.0857
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Trichomonas vaginalis CMGC family protein kinase 0.0147 0.072 0.3825
Schistosoma mansoni serine/threonine protein kinase 0.0065 0.0253 0.2759
Plasmodium falciparum glycogen synthase kinase 3 0.0061 0.0234 0.325
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.1458 1
Brugia malayi beta-lactamase 0.0043 0.0134 0.0134
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0065 0.0253 0.3514
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0055 0.0764
Trypanosoma brucei trypanothione reductase 0.0057 0.0211 0.2928
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0016 0.0221
Entamoeba histolytica protein kinase domain containing protein 0.0061 0.0234 0.1168
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0016 0.0016
Schistosoma mansoni serine/threonine protein kinase 0.0088 0.0386 0.421
Echinococcus multilocularis dna polymerase eta 0.0023 0.0016 0.0017
Echinococcus granulosus cyclin dependent kinase 1 0.0147 0.072 0.0788
Mycobacterium ulcerans hypothetical protein 0.0043 0.0134 0.1552
Echinococcus multilocularis serine:threonine protein kinase MARK2 0.0088 0.0386 0.0423
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.02 0.2184
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0134 0.0711
Brugia malayi Protein kinase domain containing protein 0.0041 0.0121 0.0121
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0147 0.072 1
Schistosoma mansoni serine/threonine protein kinase 0.0041 0.0121 0.132
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.002 0 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Echinococcus multilocularis cyclin dependent kinase 1 0.0147 0.072 0.0788
Brugia malayi glutathione reductase 0.0057 0.0211 0.0211
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trypanosoma brucei cdc2-related kinase 1 0.0147 0.072 1
Mycobacterium ulcerans beta-lactamase 0.0043 0.0134 0.1552
Echinococcus granulosus p21 activated protein kinase 1 Dpak1 0.0158 0.0783 0.0857
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.075 0.3982
Leishmania major DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.02 0.2184
Leishmania major trypanothione reductase 0.0057 0.0211 0.2928
Plasmodium vivax thioredoxin reductase, putative 0.0057 0.0211 0.2928
Toxoplasma gondii thioredoxin reductase 0.0057 0.0211 0.2928
Echinococcus multilocularis serine:threonine protein kinase PAK 3 0.0158 0.0783 0.0857
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0016 0.0017
Echinococcus granulosus serine:threonine protein kinase MARK2 0.0088 0.0386 0.0423
Brugia malayi hypothetical protein 0.003 0.0055 0.0055
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0147 0.072 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Brugia malayi intracellular kinase 0.0061 0.0234 0.0234
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0147 0.072 0.0706
Echinococcus granulosus mitogen activated protein kinase 0.0065 0.0253 0.0277
Schistosoma mansoni tyrosine kinase 0.0152 0.075 0.8172
Trichomonas vaginalis CMGC family protein kinase 0.0147 0.072 0.3825
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.0016 0.0109
Echinococcus multilocularis serine:threonine protein kinase 0.0053 0.0187 0.0204
Brugia malayi P21-Rho-binding domain containing protein 0.0152 0.075 0.075
Loa Loa (eye worm) hypothetical protein 0.0053 0.0187 0.0171
Trichomonas vaginalis CAMK family protein kinase 0.0053 0.0187 0.0991
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0065 0.0253 0.3514
Schistosoma mansoni wiskott-aldrich syndrome protein 0.0152 0.075 0.8172
Entamoeba histolytica p21-activated kinase 0.0158 0.0783 0.4108
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0145 0.0707 0.4845
Leishmania major DNA polymerase eta, putative 0.0023 0.0016 0.0221
Echinococcus multilocularis PAK box P21 Rho binding 0.0158 0.0783 0.0857
Echinococcus multilocularis p21 activated protein kinase 1 Dpak1 0.0158 0.0783 0.0857
Mycobacterium tuberculosis Probable dehydrogenase 0.013 0.0624 0.4282
Echinococcus multilocularis serine:threonine protein kinase PAK 4 0.1636 0.9138 1
Onchocerca volvulus 0.0061 0.0234 1
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0055 0.0764
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Entamoeba histolytica protein kinase, putative 0.0061 0.0234 0.1168
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0016 0.0221
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0134 0.0711
Mycobacterium tuberculosis Conserved protein 0.0043 0.0134 0.0918
Schistosoma mansoni protein kinase 0.0158 0.0783 0.8534
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Mycobacterium ulcerans lipase LipD 0.0043 0.0134 0.1552
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0253 0.1344
Echinococcus granulosus neural Wiskott Aldrich syndrome protein 0.0152 0.075 0.0821
Trichomonas vaginalis CAMK family protein kinase 0.0041 0.0121 0.0643
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.02 0.0185
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0016 0.0085
Trypanosoma brucei cdc2-related kinase 3 0.0147 0.072 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Schistosoma mansoni serine/threonine protein kinase 0.0147 0.072 0.7852
Entamoeba histolytica protein kinase, putative 0.0158 0.0783 0.4108
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0057 0.0211 0.1446
Leishmania major hypothetical protein, conserved 0.003 0.0055 0.0764
Loa Loa (eye worm) beta-lactamase 0.0043 0.0134 0.0118
Trichomonas vaginalis esterase, putative 0.0043 0.0134 0.0711
Echinococcus multilocularis PAK box P21 Rho binding 0.0152 0.075 0.0821
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0172 0.0863 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0134 0.1859
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0253 0.1344
Toxoplasma gondii ABC1 family protein 0.0043 0.0134 0.1859
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0065 0.0253 0.3514
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0134 0.0918
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0145 0.0707 0.7857
Plasmodium vivax glutathione reductase, putative 0.0057 0.0211 0.2928
Schistosoma mansoni hypothetical protein 0.0035 0.0088 0.0958
Entamoeba histolytica protein kinase, putative 0.0158 0.0783 0.4108
Echinococcus multilocularis calcium activated potassium channel 0.0041 0.0121 0.0133
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0134 0.0918
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0065 0.0253 0.3514
Trichomonas vaginalis STE family protein kinase 0.0158 0.0783 0.4158
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0134 0.0147
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0055 0.0764
Schistosoma mansoni DNA polymerase eta 0.0023 0.0016 0.0174
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0016 0.0221
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0016 0.0185
Brugia malayi WH1 domain containing protein 0.0152 0.075 0.075
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0055 0.0764
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0016 0.0016
Schistosoma mansoni serine/threonine protein kinase 0.0088 0.0386 0.421
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0134 0.0118
Plasmodium falciparum protein kinase 5 0.0147 0.072 1
Echinococcus granulosus serine:threonine protein kinase MARK2 0.0088 0.0386 0.0423
Echinococcus granulosus PAK box P21 Rho binding 0.0152 0.075 0.0821
Trichomonas vaginalis CMGC family protein kinase 0.0061 0.0234 0.1243
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0061 0.0234 0.325
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.013 0.0624 0.673
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.1883 1
Schistosoma mansoni protein kinase 0.0158 0.0783 0.8534
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0055 0.0764
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0147 0.072 0.0706
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0147 0.072 0.0788
Mycobacterium tuberculosis Conserved protein 0.0043 0.0134 0.0918
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0061 0.0234 0.2552
Echinococcus multilocularis protein kinase shaggy 0.0061 0.0234 0.0256
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.002 0 0.5
Trichomonas vaginalis STE family protein kinase 0.0158 0.0783 0.4158
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0134 0.1552
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0016 0.0017
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0061 0.0234 0.325
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0016 0.0174
Echinococcus multilocularis mitogen activated protein kinase 0.0065 0.0253 0.0277
Trichomonas vaginalis STE family protein kinase 0.0158 0.0783 0.4158
Loa Loa (eye worm) hypothetical protein 0.003 0.0055 0.0039
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.1883 1
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0147 0.072 0.0706
Loa Loa (eye worm) P21-Rho-binding domain-containing protein 0.0152 0.075 0.0735
Echinococcus multilocularis serine:threonine protein kinase MARK2 0.0088 0.0386 0.0423
Brugia malayi P21-Rho-binding domain containing protein 0.0152 0.075 0.075
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.1883 1
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0061 0.0234 0.0219
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0134 0.146
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0065 0.0253 0.3514
Giardia lamblia Kinase, CMGC MAPK 0.0065 0.0253 0.1344
Echinococcus multilocularis cyclin dependent kinase 1 0.0147 0.072 0.0788
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.02 0.02
Echinococcus granulosus serine:threonine protein kinase 0.0053 0.0187 0.0204
Echinococcus granulosus dna polymerase eta 0.0023 0.0016 0.0017
Echinococcus multilocularis serine:threonine protein kinase 0.0053 0.0187 0.0204
Loa Loa (eye worm) hypothetical protein 0.0043 0.0134 0.0118
Trypanosoma brucei protein kinase, putative 0.0061 0.0234 0.325
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.02 0.0219
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0016 0.0221
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0065 0.0253 0.3514
Trypanosoma cruzi trypanothione reductase, putative 0.0057 0.0211 0.2928

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.3294 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) 1.3115 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) = 2.5119 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 2.5119 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.9811 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) = 15.8114 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 22.3872 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 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
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 37.933 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) 39.8107 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference
Potency (functional) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ] ChEMBL. No reference
Potency (functional) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: Inhibitors of Regulator of G Protein Signaling (RGS) 4: qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504856] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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