Detailed information for compound 353310

Basic information

Technical information
  • TDR Targets ID: 353310
  • Name: propyl 3-[[5-(5-nitrothiophen-2-yl)-1,3,4-thi adiazol-2-yl]sulfanyl]propanoate
  • MW: 359.444 | Formula: C12H13N3O4S3
  • H donors: 0 H acceptors: 5 LogP: 3.47 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][N+](=O)c1ccc(s1)c1nnc(s1)SCCC(=O)OCCC
  • InChi: 1S/C12H13N3O4S3/c1-2-6-19-10(16)5-7-20-12-14-13-11(22-12)8-3-4-9(21-8)15(17)18/h3-4H,2,5-7H2,1H3
  • InChiKey: IILSDICAPDEZBI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • propyl 3-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate
  • 3-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]thio]propanoic acid propyl ester
  • 3-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]thio]propionic acid propyl ester
  • AIDS-173146
  • AIDS173146
  • Propyl 3-[5-(5-nitro-2-thienyl)-1,3,4-thiadiazole-2-yl thio] propionate

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
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Chlamydia trachomatis DNA ligase 0.002 0.0028 1
Schistosoma mansoni chromosome transmission fidelity factor 0.002 0.0028 0.00000075414
Echinococcus granulosus histone deacetylase 6 0.0381 0.4593 0.8182
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Entamoeba histolytica hypothetical protein 0.0073 0.0696 0.2076
Echinococcus multilocularis neuropeptide s receptor 0.0462 0.5607 0.5594
Schistosoma mansoni histone deacetylase hda2 0.0129 0.1407 0.2967
Brugia malayi Latrophilin receptor protein 2 0.0032 0.018 0.0332
Brugia malayi histone deacetylase 11 0.0129 0.1407 0.3021
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0597 0.1246
Brugia malayi Calcitonin receptor-like protein seb-1 0.0101 0.1051 0.224
Loa Loa (eye worm) hypothetical protein 0.0069 0.0648 0.141
Schistosoma mansoni histone deacetylase 1 2 3 0.0129 0.1407 0.2967
Entamoeba histolytica histone deacetylase, putative 0.0275 0.3246 1
Echinococcus granulosus neuroligin 0.004 0.0282 0.0455
Treponema pallidum DNA ligase (lig) 0.002 0.0028 0.5
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.002 0.0028 0.1003
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0076 0.2679
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.018 0.0152
Echinococcus granulosus histone deacetylase 0.0381 0.4593 0.8182
Brugia malayi Carboxylesterase family protein 0.004 0.0282 0.0556
Schistosoma mansoni hypothetical protein 0.0069 0.0648 0.1333
Trypanosoma cruzi histone deacetylase, putative 0.0381 0.4593 1
Schistosoma mansoni BC026374 protein (S09 family) 0.004 0.0282 0.0546
Schistosoma mansoni histone deacetylase 0.0275 0.3246 0.6923
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0101 0.1051 0.2288
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0076 0.2679
Echinococcus multilocularis histone deacetylase 8 0.0129 0.1407 0.1383
Loa Loa (eye worm) histone deacetylase 1 0.0275 0.3246 0.7067
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Mycobacterium ulcerans hypothetical protein 0.0024 0.0076 0.2679
Loa Loa (eye worm) hypothetical protein 0.0275 0.3246 0.7067
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0597 0.1224
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0597 0.13
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.0648 0.1357
Echinococcus multilocularis neuroligin 0.004 0.0282 0.0254
Toxoplasma gondii histone deacetylase HDAC4 0.0129 0.1407 0.3021
Schistosoma mansoni survival motor neuron protein 0.0048 0.0385 0.0767
Schistosoma mansoni hypothetical protein 0.0032 0.018 0.0326
Toxoplasma gondii ATPase, AAA family protein 0.002 0.0028 0.00000076787
Toxoplasma gondii histone deacetylase HDAC5 0.0129 0.1407 0.3021
Brugia malayi Histone deacetylase family protein 0.0381 0.4593 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.004 0.0282 0.0546
Echinococcus granulosus histone deacetylase 8 0.0129 0.1407 0.2472
Leishmania major histone deacetylase, putative 0.0381 0.4593 1
Trichomonas vaginalis spcc417.12 protein, putative 0.004 0.0282 0.0789
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.004 0.0282 0.0789
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0076 0.2679
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Loa Loa (eye worm) hypothetical protein 0.0237 0.2768 0.6027
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Entamoeba histolytica hypothetical protein 0.0073 0.0696 0.2076
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.004 0.0282 1
Echinococcus multilocularis neuropeptide receptor A26 0.0462 0.5607 0.5594
Onchocerca volvulus 0.004 0.0282 0.1346
Loa Loa (eye worm) carboxylesterase 0.004 0.0282 0.0614
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0258 0.3033 0.6582
Brugia malayi Carboxylesterase family protein 0.004 0.0282 0.0556
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Onchocerca volvulus Histone deacetylase 10 homolog 0.0129 0.1407 0.7317
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.2028 0.6215
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Toxoplasma gondii histone deacetylase HDAC1 0.0381 0.4593 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.004 0.0282 0.0546
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.004 0.0282 0.0254
Mycobacterium ulcerans carboxylesterase, LipT 0.004 0.0282 1
Schistosoma mansoni neuroligin 3 (S09 family) 0.004 0.0282 0.0546
Plasmodium vivax histone deacetylase 1, putative 0.0275 0.3246 0.7067
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0073 0.0696 0.067
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0101 0.1051 0.224
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0073 0.0696 0.1197
Echinococcus granulosus tar DNA binding protein 0.0065 0.0597 0.102
Leishmania major histone deacetylase, putative 0.0381 0.4593 1
Echinococcus multilocularis histone deacetylase 1 0.0275 0.3246 0.3226
Echinococcus granulosus acetylcholinesterase 0.0237 0.2768 0.4911
Echinococcus granulosus carboxylesterase 5A 0.0237 0.2768 0.4911
Schistosoma mansoni transcription factor LCR-F1 0.0073 0.0696 0.1437
Brugia malayi Histone deacetylase 1 0.0275 0.3246 0.7049
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0076 1
Echinococcus multilocularis acetylcholinesterase 0.0237 0.2768 0.2747
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0076 0.2679
Plasmodium vivax histone deacetylase, putative 0.0129 0.1407 0.3064
Schistosoma mansoni hypothetical protein 0.0032 0.018 0.0326
Trichomonas vaginalis replication factor C large subunit, putative 0.002 0.0028 0.0000010894
Echinococcus multilocularis histone deacetylase 6 0.0388 0.4676 0.4661
Echinococcus granulosus histone deacetylase 6 0.0381 0.4593 0.8182
Leishmania major histone deacetylase, putative 0.0275 0.3246 0.7018
Brugia malayi hypothetical protein 0.004 0.0282 0.0556
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.018 0.0392
Trypanosoma brucei histone deacetylase 3 0.0381 0.4593 1
Entamoeba histolytica hypothetical protein 0.0073 0.0696 0.2076
Echinococcus multilocularis histone deacetylase 6 0.0381 0.4593 0.4577
Brugia malayi histone deacetylase 3 (HD3) 0.0275 0.3246 0.7049
Trypanosoma brucei histone deacetylase 4 0.0381 0.4593 1
Echinococcus granulosus BC026374 protein S09 family 0.004 0.0282 0.0455
Schistosoma mansoni hypothetical protein 0.0048 0.0385 0.0767
Mycobacterium tuberculosis Carboxylesterase LipT 0.004 0.0282 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.018 0.0152
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Onchocerca volvulus Glucosylceramidase homolog 0.0169 0.1913 1
Trypanosoma cruzi histone deacetylase, putative 0.0129 0.1407 0.3021
Loa Loa (eye worm) hypothetical protein 0.0236 0.2758 0.6005
Plasmodium falciparum histone deacetylase 1 0.0275 0.3246 0.7067
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0165
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.018 0.0272
Leishmania major histone deacetylase, putative 0.0275 0.3246 0.7018
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0076 0.0104
Echinococcus granulosus histone deacetylase 6 0.0388 0.4676 0.8331
Brugia malayi Carboxylesterase family protein 0.0237 0.2768 0.6002
Loa Loa (eye worm) hypothetical protein 0.0032 0.018 0.0392
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0597 0.1224
Echinococcus granulosus para nitrobenzyl esterase 0.004 0.0282 0.0455
Echinococcus multilocularis histone deacetylase 7 0.0381 0.4593 0.4577
Onchocerca volvulus 0.0048 0.0385 0.1891
Trypanosoma cruzi histone deacetylase, putative 0.0381 0.4593 1
Echinococcus multilocularis histone deacetylase 6 0.0381 0.4593 0.4577
Loa Loa (eye worm) hypothetical protein 0.0129 0.1407 0.3064
Onchocerca volvulus 0.004 0.0282 0.1346
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.002 0.0028 0.0000010894
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Schistosoma mansoni hypothetical protein 0.0032 0.018 0.0326
Schistosoma mansoni hypothetical protein 0.0032 0.018 0.0326
Plasmodium falciparum histone deacetylase 2 0.0381 0.4593 1
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0076 0.0104
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Plasmodium vivax histone deacetylase, putative 0.0381 0.4593 1
Toxoplasma gondii histone deacetylase HDAC3 0.0275 0.3246 0.7049
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Echinococcus granulosus GPCR family 2 0.0032 0.018 0.0272
Echinococcus granulosus histone deacetylase 1 0.0275 0.3246 0.5767
Loa Loa (eye worm) carboxylesterase 0.0237 0.2768 0.6027
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Echinococcus multilocularis para nitrobenzyl esterase 0.004 0.0282 0.0254
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0076 0.0104
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.2028 0.6215
Brugia malayi Carboxylesterase family protein 0.0237 0.2768 0.6002
Brugia malayi RNA binding protein 0.0065 0.0597 0.1246
Entamoeba histolytica hypothetical protein 0.0073 0.0696 0.2076
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Echinococcus granulosus acetylcholinesterase 0.0237 0.2768 0.4911
Brugia malayi Carboxylesterase family protein 0.004 0.0282 0.0556
Brugia malayi histone deacetylase 1 (HD1) 0.0275 0.3246 0.7049
Trypanosoma brucei histone deacetylase 2 0.0129 0.1407 0.3021
Echinococcus multilocularis BC026374 protein (S09 family) 0.004 0.0282 0.0254
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0237 0.2768 0.5895
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0076 0.2679
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0597 0.1224
Loa Loa (eye worm) RNA binding protein 0.0065 0.0597 0.13
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.0076 0.0147
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Brugia malayi hypothetical protein 0.0073 0.0696 0.1463
Schistosoma mansoni acetylcholinesterase 0.004 0.0282 0.0546
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0597 0.13
Echinococcus granulosus family S9 non peptidase ue S09 family 0.004 0.0282 0.0455
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.004 0.0282 0.0546
Echinococcus multilocularis histone deacetylase 3 0.0275 0.3246 0.3226
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.018 0.0332
Loa Loa (eye worm) carboxylesterase 0.004 0.0282 0.0614
Onchocerca volvulus 0.004 0.0282 0.1346
Schistosoma mansoni hypothetical protein 0.0073 0.0696 0.1437
Echinococcus multilocularis histone deacetylase 0.0381 0.4593 0.4577
Brugia malayi hypothetical protein 0.0236 0.2758 0.598
Schistosoma mansoni histone deacetylase 4 5 0.0381 0.4593 0.9821
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.002 0.0028 0.0000010894
Echinococcus multilocularis carboxylesterase 5A 0.0237 0.2768 0.2747
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0165
Loa Loa (eye worm) histone deacetylase 7A 0.0381 0.4593 1
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Echinococcus granulosus neuropeptide receptor A26 0.0462 0.5607 1
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0275 0.3246 1
Plasmodium vivax replication factor C subunit 1, putative 0.002 0.0028 0.0062
Loa Loa (eye worm) histone deacetylase 3 0.0275 0.3246 0.7067
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Loa Loa (eye worm) hypothetical protein 0.002 0.0028 0.0062
Trichomonas vaginalis histone deacetylase, putative 0.0275 0.3246 1
Loa Loa (eye worm) hypothetical protein 0.0259 0.3045 0.6631
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0165
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Loa Loa (eye worm) hypothetical protein 0.0252 0.2962 0.645
Loa Loa (eye worm) acetylcholinesterase 1 0.0237 0.2768 0.6027
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.3033 0.9338
Brugia malayi Histone deacetylase family protein 0.0381 0.4593 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0258 0.3033 0.6603
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0076 0.0147
Trypanosoma brucei histone deacetylase 1 0.0275 0.3246 0.7049
Trypanosoma cruzi histone deacetylase 1, putative 0.0275 0.3246 0.7049
Onchocerca volvulus 0.004 0.0282 0.1346
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.018 0.0272
Plasmodium vivax histone deacetylase 2, putative 0.0381 0.4593 1
Brugia malayi TAR-binding protein 0.0065 0.0597 0.1246
Echinococcus multilocularis replication factor c subunit 1 0.002 0.0028 0.00000035148
Loa Loa (eye worm) histone deacetylase 11 0.0129 0.1407 0.3064
Schistosoma mansoni histone deacetylase 4 5 0.0381 0.4593 0.9821
Loa Loa (eye worm) hypothetical protein 0.0101 0.1051 0.2288
Echinococcus multilocularis acetylcholinesterase 0.0237 0.2768 0.2747
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0076 0.0147
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0076 0.2679
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0275 0.3246 1
Trypanosoma cruzi histone deacetylase, putative 0.0129 0.1407 0.3021
Onchocerca volvulus 0.004 0.0282 0.1346
Echinococcus granulosus replication factor c subunit 1 0.002 0.0028 0.00000062829
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0275 0.3246 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0076 1
Trypanosoma brucei histone deacetylase, putative 0.0381 0.4593 1
Trypanosoma cruzi histone deacetylase, putative 0.0381 0.4593 1
Plasmodium falciparum replication factor C subunit 1, putative 0.002 0.0028 0.0062
Brugia malayi Carboxylesterase family protein 0.004 0.0282 0.0556
Loa Loa (eye worm) hypothetical protein 0.0237 0.2768 0.6027
Echinococcus multilocularis survival motor neuron protein 1 0.0236 0.2758 0.2737
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0076 0.2679
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Echinococcus granulosus histone deacetylase 7 0.0381 0.4593 0.8182
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.002 0.0028 0.0000010894
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0597 0.1224
Loa Loa (eye worm) histone deacetylase 0.0381 0.4593 1
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1913 0.5858
Schistosoma mansoni gliotactin 0.004 0.0282 0.0546
Loa Loa (eye worm) hypothetical protein 0.004 0.0282 0.0614
Echinococcus multilocularis GPCR, family 2 0.0032 0.018 0.0152
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0597 0.1224
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.002 0.0028 0.5
Giardia lamblia Histone deacetylase 0.0275 0.3246 1
Trypanosoma cruzi histone deacetylase 1, putative 0.0275 0.3246 0.7049
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0597 0.057
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.004 0.0282 1
Schistosoma mansoni histone deacetylase 0.0275 0.3246 0.6923
Echinococcus granulosus survival motor neuron protein 1 0.0236 0.2758 0.4893
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0076 0.2679
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0385 0.0781
Onchocerca volvulus 0.0024 0.0076 0.0251
Echinococcus granulosus neuropeptide s receptor 0.0462 0.5607 1
Toxoplasma gondii histone deacetylase HDAC2 0.0275 0.3246 0.7049
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0076 0.2679
Plasmodium falciparum histone deacetylase, putative 0.0381 0.4593 1
Schistosoma mansoni histone deacetylase hda2 0.0388 0.4676 1
Echinococcus granulosus histone deacetylase 3 0.0275 0.3246 0.5767

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) 0 Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by microplate alamar blue assay ChEMBL. 16359863
Inhibition (functional) = 98 % Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by microplate alamar blue assay ChEMBL. 16359863
Inhibition (functional) = 98 % Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by microplate alamar blue assay ChEMBL. 16359863
MIC (functional) = 1.56 ug ml-1 Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by microplate alamar blue assay ChEMBL. 16359863
MIC (functional) = 1.56 ug ml-1 Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by microplate alamar blue assay ChEMBL. 16359863

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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