Detailed information for compound 281488

Basic information

Technical information
  • TDR Targets ID: 281488
  • Name: (3S,4S,5R)-3-acetyl-5-ethoxy-3,4-dimethyloxol an-2-one
  • MW: 200.232 | Formula: C10H16O4
  • H donors: 0 H acceptors: 2 LogP: 1.31 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCO[C@@H]1OC(=O)[C@]([C@@H]1C)(C)C(=O)C
  • InChi: 1S/C10H16O4/c1-5-13-8-6(2)10(4,7(3)11)9(12)14-8/h6,8H,5H2,1-4H3/t6-,8-,10+/m1/s1
  • InChiKey: ABNYWYXJKSMNKE-YNEQXMIYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (3S,4S,5R)-3-acetyl-5-ethoxy-3,4-dimethyl-tetrahydrofuran-2-one
  • (3S,4S,5R)-3-acetyl-5-ethoxy-3,4-dimethyl-2-tetrahydrofuranone
  • (3S,4S,5R)-3-ethanoyl-5-ethoxy-3,4-dimethyl-oxolan-2-one

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0279 0.198 0.198
Entamoeba histolytica PH domain containing protein kinase, putative 0.0619 0.4725 0.793
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0329 0.2385 0.2379
Loa Loa (eye worm) RGS-3 protein 0.0113 0.0635 0.0627
Entamoeba histolytica protein kinase, putative 0.0279 0.198 0.3197
Onchocerca volvulus 0.0485 0.3639 1
Trypanosoma brucei rac serine-threonine kinase, putative 0.0292 0.2083 0.4466
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0606 0.4622 1
Onchocerca volvulus 0.0472 0.3536 0.9456
Loa Loa (eye worm) hypothetical protein 0.0429 0.319 0.3184
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0039 0.004 0.004
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.198 0.1948
Brugia malayi Protein kinase c protein 2 0.0894 0.6942 0.694
Plasmodium vivax cAMP-dependent protein kinase catalytic subunit, putative 0.0606 0.4622 0.5
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Brugia malayi SRC-1 0.0039 0.004 0.0031
Echinococcus multilocularis Diacylglycerol kinase theta 0.0221 0.1509 0.1509
Brugia malayi Protein kinase domain containing protein 0.0238 0.1643 0.1636
Schistosoma mansoni serine/threonine protein kinase 0.0301 0.2158 0.2126
Echinococcus granulosus regulator of G protein signaling 7 0.0113 0.0635 0.0635
Trypanosoma brucei cAMP-dependent protein kinase catalytic subunit 2 0.0606 0.4622 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0056 0.0173 0.0173
Echinococcus granulosus serine:threonine protein kinase N2 0.0279 0.198 0.198
Schistosoma mansoni diacylglycerol kinase theta 0.0221 0.1509 0.1476
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.198 0.1948
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0113 0.0635 0.0627
Echinococcus multilocularis tyrosine protein kinase Srms 0.0035 0.0009 0.0009
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 2 0.0606 0.4622 1
Brugia malayi protein kinase C3,putative 0.0323 0.2335 0.2328
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0301 0.2158 0.2151
Schistosoma mansoni regulator of G protein signaling 0.0113 0.0635 0.0598
Loa Loa (eye worm) PXA domain-containing protein 0.0113 0.0635 0.0627
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Echinococcus multilocularis N chimaerin 0.0225 0.1541 0.1541
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Echinococcus granulosus Diacylglycerol kinase theta 0.0221 0.1509 0.1509
Brugia malayi RhoGAP domain containing protein 0.0225 0.1541 0.1534
Echinococcus multilocularis regulator of G protein signaling 7 0.0113 0.0635 0.0635
Echinococcus granulosus cGMP dependent protein kinase 1 0.0055 0.0167 0.0167
Echinococcus granulosus G protein coupled receptor kinase 1 0.0189 0.1247 0.1247
Brugia malayi Protein kinase domain containing protein 0.0279 0.198 0.1973
Entamoeba histolytica hypothetical protein 0.0392 0.2894 0.4773
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0113 0.0635 0.0598
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0279 0.198 0.198
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.0167 0.0128
Brugia malayi Protein kinase domain containing protein 0.0279 0.198 0.1973
Schistosoma mansoni protein kinase C mu 0.0221 0.1509 0.1476
Loa Loa (eye worm) RasGEF domain-containing protein 0.0221 0.1509 0.1502
Entamoeba histolytica protein kinase, putative 0.0279 0.198 0.3197
Echinococcus granulosus cGMP dependent protein kinase 1 0.0055 0.0167 0.0167
Brugia malayi Variant SH3 domain containing protein 0.005 0.0127 0.0118
Echinococcus multilocularis Protein kinase C, brain isozyme 0.1156 0.9065 0.9065
Loa Loa (eye worm) hypothetical protein 0.0429 0.319 0.3184
Schistosoma mansoni serine/threonine protein kinase 0.0606 0.4622 0.4601
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0225 0.1541 0.1541
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0225 0.1541 0.1541
Brugia malayi regulator of G-protein signaling egl-10 0.0113 0.0635 0.0627
Loa Loa (eye worm) hypothetical protein 0.0844 0.654 0.6537
Schistosoma mansoni protein kinase C 0.0254 0.1778 0.1745
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0113 0.0635 0.0635
Echinococcus multilocularis regulator of G protein signaling 0.0113 0.0635 0.0635
Loa Loa (eye worm) hypothetical protein 0.0251 0.1751 0.1743
Loa Loa (eye worm) AGC/PKA protein kinase 0.0606 0.4622 0.4618
Echinococcus granulosus protein kinase c iota type 0.0586 0.4457 0.4457
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Echinococcus multilocularis raf serine:threonine protein kinase 0.0222 0.1518 0.1518
Echinococcus granulosus raf serine:threonine protein kinase 0.0222 0.1518 0.1518
Brugia malayi diacylglycerol kinase 0.0221 0.1509 0.1502
Echinococcus multilocularis myotubularin protein 13 0.0234 0.1612 0.1612
Echinococcus multilocularis tyrosine protein kinase Blk 0.0035 0.0009 0.0009
Trichomonas vaginalis AGC family protein kinase 0.0606 0.4622 1
Echinococcus granulosus protein kinase c eta type 0.0221 0.1509 0.1509
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0225 0.1541 0.1507
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0279 0.198 0.1973
Echinococcus granulosus Protein kinase C brain isozyme 0.1156 0.9065 0.9065
Echinococcus granulosus regulator of G protein signaling 3 0.0113 0.0635 0.0635
Schistosoma mansoni serine/threonine protein kinase 0.1272 1 1
Brugia malayi hypothetical protein 0.0113 0.0635 0.0627
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0263 0.1847 0.3039
Echinococcus granulosus protein kinase C gamma type 0.0935 0.728 0.728
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.198 0.1948
Echinococcus multilocularis serine:threonine protein kinase N2 0.0279 0.198 0.198
Brugia malayi cAMP-dependent protein kinase catalytic subunit, putative 0.0606 0.4622 0.4618
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0039 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0234 0.1612 0.1605
Schistosoma mansoni serine/threonine protein kinase 0.0606 0.4622 0.4601
Brugia malayi hypothetical protein 0.0113 0.0635 0.0627
Brugia malayi Hr1 repeat family protein 0.0279 0.198 0.1973
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0039 0.004 0.004
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0623 0.4755 0.4755
Toxoplasma gondii AGC kinase 0.0279 0.198 0.407
Echinococcus multilocularis G protein coupled receptor kinase 6 0.0494 0.3716 0.3716
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0607 0.4627 0.4623
Echinococcus multilocularis protein kinase c eta type 0.0221 0.1509 0.1509
Schistosoma mansoni unc-13 (munc13) 0.0254 0.1778 0.1745
Echinococcus multilocularis regulator of G protein signaling 3 0.0113 0.0635 0.0635
Schistosoma mansoni atypical protein kinase C 0.0592 0.4508 0.4486
Echinococcus granulosus regulator of G protein signaling 3 0.0113 0.0635 0.0635
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Echinococcus granulosus RNA directed DNA polymerase 0.0623 0.4755 0.4755
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0055 0.0167 0.0167
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Brugia malayi Pleckstrin Homology Domain 0.0234 0.1612 0.1605
Brugia malayi A-kinase anchor protein 10, precursor 0.0113 0.0635 0.0627
Schistosoma mansoni axis inhibition protein axin 0.0113 0.0635 0.0598
Loa Loa (eye worm) hypothetical protein 0.0708 0.5446 0.5442
Brugia malayi Variant SH3 domain containing protein 0.0225 0.1541 0.1534
Onchocerca volvulus 0.0429 0.319 0.762
Echinococcus granulosus [G-protein-coupledreceptor] kinase 0.0494 0.3716 0.3716
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0254 0.1778 0.1778
Schistosoma mansoni vav2 0.0238 0.1644 0.1611
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0607 0.4627 0.4623
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0039 0.004 0.004
Schistosoma mansoni protein kinase C mu 0.0488 0.367 0.3645
Echinococcus granulosus tyrosine protein kinase Fyn 0.0039 0.004 0.004
Schistosoma mansoni serine/threonine protein kinase 0.0607 0.4627 0.4606
Echinococcus multilocularis intersectin 2 0.0037 0.0023 0.0023
Schistosoma mansoni unc-13 (munc13) 0.0254 0.1778 0.1745
Schistosoma mansoni serine/threonine protein kinase 0.0606 0.4622 0.4601
Loa Loa (eye worm) AGC/PKG protein kinase 0.0055 0.0167 0.0158
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 1 0.0606 0.4622 1
Loa Loa (eye worm) hypothetical protein 0.0606 0.4622 0.4618
Trypanosoma brucei cAMP-dependent protein kinase catalytic subunit 1 0.0606 0.4622 1
Schistosoma mansoni serine/threonine protein kinase 0.0238 0.1643 0.161
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0039 0.004 0.004
Echinococcus granulosus beta-adrenergic receptor kinase 0.0301 0.2158 0.2158
Schistosoma mansoni serine/threonine protein kinase 0.0238 0.1643 0.161
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0225 0.1541 0.1507
Echinococcus multilocularis regulator of G protein signaling 7 0.0113 0.0635 0.0635
Echinococcus granulosus tyrosine protein kinase Fyn 0.0039 0.004 0.004
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0494 0.3716 0.3711
Brugia malayi Regulator of G protein signaling domain containing protein 0.0113 0.0635 0.0627
Schistosoma mansoni diacylglycerol kinase theta 0.0221 0.1509 0.1476
Echinococcus granulosus cGMP dependent protein kinase 0.0055 0.0167 0.0167
Loa Loa (eye worm) hypothetical protein 0.0251 0.1751 0.1743
Brugia malayi regulator of G-protein signaling rgs-7 0.0113 0.0635 0.0627
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.1272 1 1
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Entamoeba histolytica hypothetical protein 0.0221 0.1509 0.2385
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0113 0.0635 0.0598
Loa Loa (eye worm) hypothetical protein 0.0485 0.3639 0.3633
Echinococcus granulosus tyrosine protein kinase Src42A 0.0039 0.004 0.004
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0488 0.367 0.3664
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0055 0.0167 0.0167
Echinococcus granulosus tyrosine kinase 0.0035 0.0009 0.0009
Brugia malayi PXA domain containing protein 0.0113 0.0635 0.0627
Entamoeba histolytica PH domain containing protein kinase, putative 0.0768 0.5925 1
Schistosoma mansoni regulator of G protein signaling 0.0113 0.0635 0.0598
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Echinococcus granulosus tyrosine protein kinase Blk 0.0035 0.0009 0.0009
Brugia malayi RhoGEF domain containing protein 0.0221 0.1509 0.1502
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Echinococcus multilocularis Regulator of G protein signaling 20 0.0113 0.0635 0.0635
Schistosoma mansoni serine/threonine protein kinase 0.1156 0.9065 0.9062
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.0167 0.0128
Leishmania major protein kinase A catalytic subunit 0.0606 0.4622 1
Echinococcus multilocularis serine:threonine protein kinase 38 0.0279 0.198 0.198
Onchocerca volvulus 0.0254 0.1778 0.0146
Echinococcus granulosus serine:threonine protein kinase N2 0.0755 0.5823 0.5823
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Plasmodium falciparum cAMP-dependent protein kinase catalytic subunit 0.0606 0.4622 1
Echinococcus granulosus Rac GTPase activating protein 1 0.0221 0.1509 0.1509
Loa Loa (eye worm) variant SH3 domain-containing protein 0.005 0.0127 0.0118
Loa Loa (eye worm) hypothetical protein 0.065 0.4975 0.4971
Trichomonas vaginalis AGC family protein kinase 0.0279 0.198 0.3374
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0279 0.198 0.198
Echinococcus multilocularis enhancer of mRNA decapping protein 4 0.059 0.4489 0.4489
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0035 0.0009 0.0009
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0225 0.1541 0.1534
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0279 0.198 0.198
Brugia malayi p70 ribosomal S6 kinase beta 0.0279 0.198 0.1973
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0267 0.1884 0.1877
Echinococcus granulosus intersectin 2 0.0037 0.0023 0.0023
Brugia malayi Protein kinase domain containing protein 0.0292 0.2083 0.2076
Echinococcus granulosus axis inhibition protein axin 0.0113 0.0635 0.0635
Schistosoma mansoni regulator of G protein signaling 0.0113 0.0635 0.0598
Echinococcus multilocularis expressed protein 0.0113 0.0635 0.0635
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Echinococcus granulosus enhancer of mRNA decapping protein 4 0.059 0.4489 0.4489
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0039 0.004 0.004
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0039 0.004 0.004
Echinococcus granulosus axis inhibition protein axin 0.0113 0.0635 0.0635
Echinococcus multilocularis protein kinase c epsilon type 0.1272 1 1
Toxoplasma gondii protein kinase, cAMP-dependent, catalytic chain 0.0606 0.4622 1
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0039 0.004 0.004
Echinococcus granulosus expressed protein 0.0113 0.0635 0.0635
Loa Loa (eye worm) SRC-1 0.0039 0.004 0.0031
Toxoplasma gondii AGC kinase 0.0606 0.4622 1
Trypanosoma brucei protein kinase A catalytic subunit, putative 0.0606 0.4622 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0039 0.004 0.004
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0606 0.4622 1
Echinococcus multilocularis serine threonine protein kinase 0.0935 0.728 0.728
Giardia lamblia Kinase, AGC PKA 0.0606 0.4622 0.5
Loa Loa (eye worm) G protein-coupled receptor kinase 1 0.0494 0.3716 0.3711
Entamoeba histolytica hypothetical protein 0.0113 0.0635 0.0878
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0279 0.198 0.1973
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0279 0.198 0.198
Entamoeba histolytica protein kinase, putative 0.0292 0.2083 0.3374
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0238 0.1643 0.1643
Entamoeba histolytica protein kinase, putative 0.0292 0.2083 0.3374
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0494 0.3716 0.3711
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Leishmania major protein kinase A catalytic subunit isoform 2 0.0606 0.4622 1
Entamoeba histolytica hypothetical protein 0.0113 0.0635 0.0878
Echinococcus granulosus protein kinase c epsilon type 0.1272 1 1
Schistosoma mansoni z-protein (S1r protein) 0.0113 0.0635 0.0598
Echinococcus granulosus N chimaerin 0.0225 0.1541 0.1541
Leishmania major protein kinase A catalytic subunit isoform 1 0.0606 0.4622 1
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0279 0.198 0.198
Entamoeba histolytica diacylglycerol kinase, putative 0.0221 0.1509 0.2385
Loa Loa (eye worm) AGC/PKN protein kinase 0.0279 0.198 0.1973
Entamoeba histolytica diacylglycerol kinase, putative 0.0221 0.1509 0.2385
Loa Loa (eye worm) hypothetical protein 0.0472 0.3536 0.3531
Echinococcus multilocularis expressed conserved protein 0.0055 0.0167 0.0167
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0113 0.0635 0.0635
Loa Loa (eye worm) hypothetical protein 0.0254 0.1778 0.1771
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0238 0.1643 0.1643
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Schistosoma mansoni regulator of G protein signaling 0.0113 0.0635 0.0598
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0039 0.004 0.004
Schistosoma mansoni serine/threonine kinase 0.0279 0.198 0.1948
Brugia malayi Egg laying defective protein 4 0.0055 0.0167 0.0158
Loa Loa (eye worm) AGC/NDR protein kinase 0.0279 0.198 0.1973
Entamoeba histolytica PH domain containing protein kinase, putative 0.0619 0.4725 0.793
Echinococcus granulosus NDR protein kinase 0.0279 0.198 0.198
Schistosoma mansoni rac gtpase activating protein 0.0221 0.1509 0.1476
Echinococcus multilocularis axis inhibition protein axin 0.0113 0.0635 0.0635
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0039 0.004 0.004
Trichomonas vaginalis AGC family protein kinase 0.0279 0.198 0.3374
Mycobacterium ulcerans hypothetical protein 0.0038 0.0034 0.5
Toxoplasma gondii diacylglycerol kinase, putative 0.0221 0.1509 0.3013
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0279 0.198 0.1973
Entamoeba histolytica hypothetical protein 0.0113 0.0635 0.0878
Echinococcus multilocularis unc 13 (munc13) 0.0254 0.1778 0.1778
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Echinococcus multilocularis beta adrenergic receptor kinase 0.0301 0.2158 0.2158
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0113 0.0635 0.0598
Schistosoma mansoni serine/threonine protein kinase 0.1156 0.9065 0.9062
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Echinococcus granulosus tyrosine protein kinase Fyn 0.0039 0.004 0.004
Echinococcus granulosus tyrosine protein kinase Src64B 0.0039 0.004 0.004
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0221 0.1509 0.1502
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.198 0.1948
Brugia malayi Regulator of G protein signaling domain containing protein 0.0113 0.0635 0.0627
Echinococcus granulosus Regulator of G protein signaling 20 0.0113 0.0635 0.0635
Schistosoma mansoni serine/threonine protein kinase 0.0222 0.1518 0.1485
Echinococcus multilocularis Rac GTPase activating protein 1 0.0221 0.1509 0.1509
Echinococcus granulosus myotubularin protein 13 0.0234 0.1612 0.1612
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Echinococcus multilocularis regulator of G protein signaling 3 0.0113 0.0635 0.0635
Echinococcus granulosus regulator of G protein signaling 7 0.0113 0.0635 0.0635
Echinococcus multilocularis axis inhibition protein axin 0.0113 0.0635 0.0635
Schistosoma mansoni regulator of G protein signaling 0.0113 0.0635 0.0598
Schistosoma mansoni hypothetical protein 0.0221 0.1509 0.1476
Echinococcus multilocularis RNA directed DNA polymerase 0.0623 0.4755 0.4755
Echinococcus multilocularis protein kinase c iota type 0.0586 0.4457 0.4457
Brugia malayi Ras association domain family 1 isoform A 0.0221 0.1509 0.1502
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0254 0.1778 0.1778
Loa Loa (eye worm) AGC/PKA protein kinase 0.0606 0.4622 0.4618
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0488 0.367 0.3664
Brugia malayi C1-like domain containing protein 0.0488 0.367 0.3664
Schistosoma mansoni axis inhibition protein axin 0.0113 0.0635 0.0598
Loa Loa (eye worm) hypothetical protein 0.0429 0.319 0.3184
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0221 0.1509 0.1502
Brugia malayi RhoGAP domain containing protein 0.0221 0.1509 0.1502
Trichomonas vaginalis AGC family protein kinase 0.0292 0.2083 0.3632
Echinococcus multilocularis G protein coupled receptor kinase 1 0.0189 0.1247 0.1247
Schistosoma mansoni serine/threonine protein kinase 0.0301 0.2158 0.2126
Echinococcus multilocularis serine:threonine protein kinase N2 0.1018 0.7946 0.7946
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0673 0.5157 0.5152
Loa Loa (eye worm) AGC/AKT protein kinase 0.0292 0.2083 0.2076
Echinococcus granulosus unc 13 munc13 0.0254 0.1778 0.1778
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0606 0.4622 0.4622
Loa Loa (eye worm) hypothetical protein 0.0623 0.4755 0.475
Trichomonas vaginalis AGC family protein kinase 0.0279 0.198 0.3374
Brugia malayi diacylglycerol kinase 0.0221 0.1509 0.1502
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0279 0.198 0.1973
Loa Loa (eye worm) raf kinase 0.0221 0.1509 0.1502
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0035 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0221 0.1509 0.1502
Loa Loa (eye worm) hypothetical protein 0.0113 0.0635 0.0627
Brugia malayi PXA domain containing protein 0.0113 0.0635 0.0627
Toxoplasma gondii AGC kinase 0.0606 0.4622 1

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.774 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.746 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.636 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.561 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against B16 mouse melanoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against DA-3 mouse mammary adenocarcinoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against HT-29 human colon adenocarcinoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against MCF7-WT human breast adenocarcinoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against B16 mouse melanoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against HT-29 human colon adenocarcinoma cells in MTT assay ChEMBL. No reference
IC50 (functional) > 50 uM Tested for cytotoxic activity against MCF7-WT human breast adenocarcinoma cells in MTT assay ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.