Detailed information for compound 1397418

Basic information

Technical information
  • TDR Targets ID: 1397418
  • Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phe nylbutanamide
  • MW: 317.449 | Formula: C17H23N3OS
  • H donors: 1 H acceptors: 3 LogP: 3.97 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(c1nnc(s1)NC(=O)CC(c1ccccc1)C)CC
  • InChi: 1S/C17H23N3OS/c1-4-13(5-2)16-19-20-17(22-16)18-15(21)11-12(3)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3,(H,18,20,21)
  • InChiKey: FDMJSQBTTGTOLE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-butanamide
  • N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-phenylbutanamide
  • N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-butyramide
  • N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenyl-butanamide
  • ST5025350
  • BAS 06981158
  • N-[5-(1-Ethyl-propyl)-[1,3,4]thiadiazol-2-yl]-3-phenyl-butyramide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide 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
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0042 0.0043
Loa Loa (eye worm) AUR protein kinase 0.007 0.0632 0.0618
Trypanosoma cruzi aurora B kinase, putative 0.007 0.0632 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0514 0.0499
Brugia malayi beta-lactamase family protein 0.0043 0.032 0.0304
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.032 0.0522
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.032 0.0304
Echinococcus granulosus tyrosine protein kinase Lyn 0.0024 0.0091 0.0061
Mycobacterium ulcerans short chain dehydrogenase 0.0033 0.0195 0.0215
Mycobacterium ulcerans lipase LipD 0.0043 0.032 0.0522
Mycobacterium tuberculosis Conserved protein 0.0043 0.032 0.0522
Schistosoma mansoni apoptosis regulator bax 0.0053 0.0434 0.0436
Schistosoma mansoni plexin 0.0018 0.0018 0.0018
Brugia malayi Immunoglobulin I-set domain containing protein 0.0163 0.1708 0.17
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0108 0.0314
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.032 0.0321
Brugia malayi Protein kinase domain containing protein 0.0057 0.0476 0.046
Schistosoma mansoni cell adhesion molecule 0.0016 0.0002 0.0002
Trypanosoma brucei beta-ketoacyl-ACP reductase 0.0025 0.0108 0.0314
Entamoeba histolytica 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0025 0.0108 0.0314
Chlamydia trachomatis enoyl-acyl-carrier protein reductase 0.0374 0.4159 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0514 0.0499
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0036 0.0036
Trichomonas vaginalis CMGC family protein kinase 0.0057 0.0476 0.0406
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0036 0.0005
Echinococcus granulosus epidermal growth factor receptor 0.0458 0.5136 0.5121
Onchocerca volvulus Tyrosine kinase homolog 0.0153 0.159 1
Brugia malayi Protein kinase domain containing protein 0.0872 0.9958 1
Onchocerca volvulus 0.0043 0.032 0.1919
Echinococcus multilocularis activin receptor type 0.0024 0.0091 0.0091
Brugia malayi beta-lactamase family protein 0.0043 0.032 0.0304
Plasmodium vivax hypothetical protein, conserved 0.0043 0.032 0.0522
Schistosoma mansoni hypothetical protein 0.0053 0.0434 0.0436
Echinococcus granulosus aurora kinase A 0.007 0.0632 0.0604
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0053 0.0434 0.0405
Echinococcus granulosus 3 oxoacyl acyl carrier protein reductase 0.0025 0.0108 0.0078
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0036 0.0018
Mycobacterium ulcerans beta-lactamase 0.0043 0.032 0.0522
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Schistosoma mansoni titin 0.002 0.0042 0.0043
Loa Loa (eye worm) hypothetical protein 0.0448 0.5019 0.5032
Schistosoma mansoni dihydropteridine reductase 0.0025 0.0108 0.0109
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.032 0.0304
Echinococcus multilocularis GPCR, family 2 0.0019 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0053 0.0434 0.0419
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0293 0.0276
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0374 0.4159 1
Toxoplasma gondii ABC1 family protein 0.0043 0.032 0.0561
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0108 0.0091
Entamoeba histolytica protein kinase, putative 0.007 0.0632 1
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0374 0.4159 1
Mycobacterium tuberculosis Conserved protein 0.0043 0.032 0.0522
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0033 0.0195 0.1923
Schistosoma mansoni 3-oxoacyl-[ACP] reductase 0.0025 0.0108 0.0109
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0025 0.0108 0.0091
Onchocerca volvulus 0.0033 0.0195 0.1128
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0057 0.0476 0.7105
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0053 0.0434 0.0436
Plasmodium vivax protein kinase Crk2 0.0057 0.0476 0.0907
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0057 0.0476 0.0447
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0036 0.0036
Trichomonas vaginalis CMGC family protein kinase 0.0057 0.0476 0.0406
Echinococcus multilocularis insulin receptor 0.0872 0.9958 0.9958
Onchocerca volvulus 0.0025 0.0108 0.0575
Mycobacterium tuberculosis Conserved protein 0.0043 0.032 0.0522
Echinococcus multilocularis titin 0.002 0.0042 0.0042
Brugia malayi serine/threonine kinase 12 0.007 0.0632 0.0618
Trichomonas vaginalis AGC family protein kinase 0.007 0.0632 0.0814
Echinococcus multilocularis dual specificity testis specific protein kinase 0.0024 0.0091 0.0091
Mycobacterium leprae conserved hypothetical protein 0.0043 0.032 0.0522
Schistosoma mansoni tyrosine kinase 0.0458 0.5136 0.5158
Echinococcus granulosus twitchin 0.0025 0.011 0.008
Leishmania major oxidoreductase-like protein 0.0033 0.0195 0.1923
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0053 0.0434 0.0434
Echinococcus granulosus activin receptor type 0.0024 0.0091 0.0061
Schistosoma mansoni serine/threonine protein kinase 0.0057 0.0476 0.0478
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0374 0.4159 1
Schistosoma mansoni tyrosine kinase 0.0528 0.595 0.5975
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0036 0.0018
Schistosoma mansoni tyrosine kinase 0.0447 0.5016 0.5038
Schistosoma mansoni hypothetical protein 0.0041 0.0293 0.0294
Trichomonas vaginalis hypothetical protein 0.0374 0.4159 1
Schistosoma mansoni protein kinase 0.0024 0.0091 0.0092
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0108 0.0314
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.032 0.0522
Entamoeba histolytica protein kinase, putative 0.007 0.0632 1
Leishmania major pteridine reductase 1 0.0033 0.0195 0.1923
Loa Loa (eye worm) hypothetical protein 0.006 0.0514 0.0499
Schistosoma mansoni tyrosine kinase 0.0872 0.9958 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0318 0.0302
Echinococcus multilocularis 3 oxoacyl acyl carrier protein reductase 0.0025 0.0108 0.0108
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0053 0.0434 0.0419
Trypanosoma brucei cdc2-related kinase 3 0.0057 0.0476 0.7105
Trichomonas vaginalis AGC family protein kinase 0.007 0.0632 0.0814
Loa Loa (eye worm) hypothetical protein 0.0025 0.0108 0.0091
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0033 0.0195 0.0215
Brugia malayi Protein kinase domain containing protein 0.0458 0.5139 0.5152
Loa Loa (eye worm) oxidoreductase 0.0025 0.0108 0.0091
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0033 0.0195 0.0215
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0108 0.0314
Entamoeba histolytica protein kinase , putative 0.007 0.0632 1
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0374 0.4159 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.032 0.029
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.032 0.0522
Mycobacterium ulcerans hypothetical protein 0.0043 0.032 0.0522
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.032 0.4222
Loa Loa (eye worm) beta-lactamase 0.0043 0.032 0.0304
Leishmania major protein kinase, putative 0.007 0.0632 1
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.007 0.0632 1
Echinococcus multilocularis cyclin dependent kinase 0.0057 0.0476 0.0476
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0057 0.0476 0.046
Echinococcus multilocularis cyclin dependent kinase 5 0.0057 0.0476 0.0476
Loa Loa (eye worm) CAMK protein kinase 0.002 0.0042 0.0025
Echinococcus granulosus insulin receptor 0.0872 0.9958 0.9957
Echinococcus multilocularis 0.0154 0.1606 0.1606
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0458 0.5136 0.5121
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.3045 0.7249
Loa Loa (eye worm) hypothetical protein 0.0041 0.0293 0.0276
Schistosoma mansoni protein kinase 0.0024 0.0091 0.0092
Echinococcus multilocularis epidermal growth factor receptor 0.0528 0.595 0.595
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Echinococcus granulosus serine:threonine protein kinase 12 B 0.007 0.0632 0.0604
Schistosoma mansoni hypothetical protein 0.0053 0.0434 0.0436
Schistosoma mansoni hypothetical protein 0.0019 0.0036 0.0036
Echinococcus granulosus plexin a4 0.0021 0.0055 0.0025
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.032 0.032
Loa Loa (eye worm) retinol dehydrogenase 12 0.0025 0.0108 0.0091
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0108 0.0091
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0023 0.0078 0.0061
Plasmodium vivax serine/threonine protein kinase 6, putative 0.007 0.0632 0.1293
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0057 0.0476 0.0945
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0668 0.7582 0.7575
Onchocerca volvulus 0.0043 0.032 0.1919
Mycobacterium leprae Probable lipase LipE 0.0043 0.032 0.0522
Brugia malayi beta-lactamase 0.0043 0.032 0.0304
Plasmodium falciparum enoyl-acyl carrier reductase 0.0374 0.4159 1
Loa Loa (eye worm) TK/EGFR protein kinase 0.0528 0.595 0.5968
Onchocerca volvulus 0.002 0.0042 0.0155
Schistosoma mansoni tyrosine kinase 0.0872 0.9958 1
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.007 0.0632 0.0632
Entamoeba histolytica cell division protein kinase 2, putative 0.0057 0.0476 0.7105
Trypanosoma cruzi cdc2-related kinase 1 0.0057 0.0476 0.7105
Trypanosoma brucei aurora B kinase 0.007 0.0632 1
Schistosoma mansoni hypothetical protein 0.0019 0.0036 0.0036
Plasmodium falciparum serine/threonine protein kinase, putative 0.007 0.0632 0.133
Trypanosoma cruzi cdc2-related kinase 1 0.0057 0.0476 0.7105
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0057 0.0476 0.046
Echinococcus granulosus cyclin dependent kinase 0.0057 0.0476 0.0447
Entamoeba histolytica protein kinase domain containing protein 0.007 0.0632 1
Echinococcus granulosus GPCR family 2 0.0019 0.0036 0.0005
Giardia lamblia Aurora kinase 0.007 0.0632 1
Schistosoma mansoni protein kinase 0.0024 0.0091 0.0092
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.007 0.0632 1
Loa Loa (eye worm) AUR protein kinase 0.007 0.0632 0.0618
Leishmania major 3-oxoacyl-ACP reductase, putative 0.0025 0.0108 0.0314
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.032 0.0522
Trichomonas vaginalis CMGC family protein kinase 0.0057 0.0476 0.0406
Brugia malayi cell division control protein 2 homolog 0.0057 0.0476 0.046
Trypanosoma brucei cdc2-related kinase 1 0.0057 0.0476 0.7105
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0163 0.1708 0.17
Schistosoma mansoni hypothetical protein 0.0019 0.0036 0.0036
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.032 0.0522
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.032 0.4222
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.007 0.0632 1
Plasmodium falciparum protein kinase 5 0.0057 0.0476 0.0945
Trichomonas vaginalis AGC family protein kinase 0.007 0.0632 0.0814
Entamoeba histolytica cell division protein kinase 2, putative 0.0057 0.0476 0.7105
Plasmodium falciparum 3-oxoacyl-[acyl-carrier-protein] reductase 0.0025 0.0108 0.0042
Schistosoma mansoni hypothetical protein 0.0053 0.0434 0.0436
Mycobacterium tuberculosis Probable oxidoreductase 0.0033 0.0195 0.0215
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.032 0.0522
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Schistosoma mansoni serine/threonine protein kinase 0.0057 0.0476 0.0478
Trypanosoma cruzi cdc2-related kinase 3 0.0057 0.0476 0.7105
Schistosoma mansoni hypothetical protein 0.0019 0.0036 0.0036
Trypanosoma brucei pteridine reductase 1 0.0025 0.0108 0.0314
Onchocerca volvulus 0.0043 0.032 0.1919
Echinococcus granulosus titin 0.002 0.0042 0.0012
Trypanosoma cruzi cdc2-related kinase 3 0.0057 0.0476 0.7105
Echinococcus multilocularis cyclin dependent kinase 1 0.0057 0.0476 0.0476
Echinococcus multilocularis cyclin dependent kinase 1 0.0057 0.0476 0.0476
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0033 0.0195 0.0256
Schistosoma mansoni tyrosine kinase 0.0458 0.5136 0.5158
Echinococcus granulosus titin 0.002 0.0042 0.0012
Echinococcus multilocularis epidermal growth factor receptor 0.0458 0.5136 0.5136
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0057 0.0476 0.7105
Toxoplasma gondii short chain dehydrogenase family protein, putative 0.0025 0.0108 0.0042
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.032 0.4222
Toxoplasma gondii aurora kinase 0.007 0.0632 0.133
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.032 0.0522
Schistosoma mansoni serine/threonine protein kinase 0.007 0.0632 0.0635
Toxoplasma gondii 3-ketoacyl-(acyl-carrier-protein) reductase 0.0025 0.0108 0.0042
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.032 0.0522
Echinococcus multilocularis plexin a4 0.0021 0.0055 0.0055
Echinococcus granulosus cyclin dependent kinase 5 0.0057 0.0476 0.0447
Schistosoma mansoni protein kinase 0.007 0.0632 0.0635
Loa Loa (eye worm) plexin A 0.0021 0.0055 0.0038
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Trypanosoma brucei oxidoreductase-like protein 0.0033 0.0195 0.1923
Brugia malayi serine/threonine-protein kinase 6 0.007 0.0632 0.0618
Echinococcus multilocularis roundabout 2 0.0019 0.003 0.003
Loa Loa (eye worm) TK/INSR protein kinase 0.0872 0.9958 1
Brugia malayi plexin A 0.0021 0.0055 0.0038
Schistosoma mansoni tyrosine kinase 0.0447 0.5016 0.5038
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0668 0.7582 0.7582
Brugia malayi serine/threonine protein kinase 6 0.007 0.0632 0.0618
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0108 0.0314
Echinococcus granulosus cyclin dependent kinase 1 0.0057 0.0476 0.0447
Brugia malayi Furin-like cysteine rich region family protein 0.0528 0.595 0.5968
Onchocerca volvulus 0.014 0.1443 0.9062
Trichomonas vaginalis AGC family protein kinase 0.007 0.0632 0.0814
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0514 0.0499
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.002 0.0042 0.0025
Echinococcus granulosus dual specificity testis-specific protein kinase 0.0024 0.0091 0.0061
Echinococcus granulosus epidermal growth factor receptor 0.0528 0.595 0.5938
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.032 0.0321
Schistosoma mansoni tyrosine kinase 0.0447 0.5016 0.5038
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0057 0.0476 0.046
Leishmania major hypothetical protein, conserved 0.0043 0.032 0.4222
Loa Loa (eye worm) apoptosis regulator protein 0.0053 0.0434 0.0419
Brugia malayi Immunoglobulin I-set domain containing protein 0.002 0.0042 0.0025
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.032 0.0522
Echinococcus multilocularis aurora kinase A 0.007 0.0632 0.0632
Brugia malayi protein unc-22 0.002 0.0042 0.0025
Loa Loa (eye worm) hypothetical protein 0.0043 0.032 0.0304
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0036 0.0018
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0036 0.0005
Loa Loa (eye worm) AUR protein kinase 0.007 0.0632 0.0618
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0374 0.4159 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0036 0.0018
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0374 0.4159 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0033 0.0195 0.0215

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 75 um PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Compounds Cytotoxic to BJ-TERT-LT-ST RAS-Independent Fibroblast. (Class of assay: confirmatory) [Related pubchem assays: 1674 (Project Summary), 1554 (Primary HTS)] ChEMBL. No reference
EC50 (functional) > 150 um PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Compounds Cytotoxic to BJ-TERT RAS-Independent Fibroblast. (Class of assay: confirmatory) [Related pubchem assays: 1674 (Project Summary), 1554 (Primary HTS)] ChEMBL. No reference
EC50 (functional) > 150 um PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Compounds Cytotoxic to BJeLR RAS-Dependent Fibroblast. (Class of assay: confirmatory) [Related pubchem assays: 1674 (Project Summary), 1554 (Primary HTS)] ChEMBL. No reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 21.1923 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 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) 100 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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.

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