Detailed information for compound 1398850

Basic information

Technical information
  • TDR Targets ID: 1398850
  • Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N'-phe nylsulfonylbenzenecarboximidamide
  • MW: 392.431 | Formula: C20H16N4O3S
  • H donors: 3 H acceptors: 4 LogP: 4.26 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1nc2c([nH]1)ccc(c2)NC(=NS(=O)(=O)c1ccccc1)c1ccccc1
  • InChi: 1S/C20H16N4O3S/c25-20-22-17-12-11-15(13-18(17)23-20)21-19(14-7-3-1-4-8-14)24-28(26,27)16-9-5-2-6-10-16/h1-13H,(H,21,24)(H2,22,23,25)
  • InChiKey: MEOQGZMSAZYESR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N'-phenylsulfonyl-benzamidine
  • N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N'-phenylsulfonylbenzamidine
  • N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-N'-phenylsulfonyl-benzamidine
  • N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N'-phenylsulfonyl-benzenecarboximidamide
  • ZINC04478382
  • MLS000582928
  • N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-N'-(phenylsulfonyl)benzenecarboximidamide
  • SMR000201634
  • ZINC04247692
  • ZINC02390712

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor 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 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium falciparum hexose transporter 0.0107 0.1773 0.2094
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0048 0.064 0.064
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Echinococcus multilocularis calcium dependent protein kinase 0.0031 0.0303 0.0303
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0032 0.0329 1
Giardia lamblia Lysyl-tRNA synthetase 0.0024 0.017 0.0598
Schistosoma mansoni serine/threonine protein kinase 0.0033 0.0342 0.0433
Brugia malayi jmjC domain containing protein 0.0053 0.0724 0.0724
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0032 0.0329 0.0329
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0078 0.0078
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0107 0.1773 0.1773
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0037 0.0432 0.0779
Loa Loa (eye worm) hypothetical protein 0.0032 0.0329 0.0531
Trypanosoma brucei glucose transporter 1E 0.0033 0.035 0.4748
Schistosoma mansoni protein kinase 0.0033 0.0342 0.0433
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0053 0.0737 0.0934
Plasmodium falciparum calcium-dependent protein kinase 2 0.0033 0.0342 0.0404
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0053 0.0724 1
Brugia malayi jmjC domain containing protein 0.0053 0.0724 0.0724
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0173 0.3044 0.5495
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0432 0.5961
Loa Loa (eye worm) jmjC domain-containing protein 0.0053 0.0724 0.1168
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0033 0.0342 0.0342
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0078 0.0125
Loa Loa (eye worm) hypothetical protein 0.0026 0.0213 0.0343
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0099
Schistosoma mansoni metabotropic glutamate receptor 0.0033 0.0343 0.0435
Schistosoma mansoni phd/f-box containing protein 0.0053 0.0724 0.0918
Leishmania major protein kinase, putative 0.0033 0.0342 0.472
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0032 0.0329 0.0329
Echinococcus granulosus metabotropic glutamate receptor 5 0.0048 0.064 0.064
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0032 0.0329 0.0329
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0099
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0024 0.017 0.2355
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0053 0.0724 0.0724
Schistosoma mansoni hypothetical protein 0.0041 0.0505 0.064
Schistosoma mansoni protein kinase 0.0033 0.0342 0.0433
Toxoplasma gondii WD domain, G-beta repeat-containing protein 0.0053 0.0737 0.133
Echinococcus multilocularis jumonji domain containing 1A 0.0053 0.0724 0.0724
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0053 0.0737 1
Brugia malayi Metabotropic glutamate receptor precursor. 0.0039 0.0465 0.0465
Entamoeba histolytica protein kinase, putative 0.0033 0.0342 1
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0033 0.0342 0.4639
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0432 0.5961
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0078 0.0078
Loa Loa (eye worm) hypothetical protein 0.0048 0.064 0.1033
Trypanosoma brucei glucose transporter 2A 0.0033 0.035 0.4748
Leishmania major glucose transporter, lmgt1 0.0033 0.035 0.4832
Brugia malayi jmjC domain containing protein 0.0053 0.0724 0.0724
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0053 0.0724 0.1307
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0032 0.0329 0.9253
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.035 0.1973
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.017 0.0961
Loa Loa (eye worm) PHD-finger family protein 0.0163 0.2852 0.4602
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.035 0.1973
Trichomonas vaginalis glucose transporter, putative 0.0033 0.035 0.1973
Plasmodium falciparum phd finger protein, putative 0.0163 0.2852 0.3367
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0021 0.0114 0.0641
Echinococcus granulosus General substrate transporter 0.0092 0.1483 0.1483
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0078 0.0078
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0024 0.017 0.2314
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.035 0.4748
Trypanosoma cruzi hexose transporter, putative 0.0033 0.035 0.4832
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0033 0.0342 0.0551
Leishmania major glucose transporter, lmgt3 0.0033 0.035 0.4832
Plasmodium falciparum protein kinase 7 0.0302 0.554 0.6542
Schistosoma mansoni metabotropic glutamate receptor 0.0019 0.0078 0.0099
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0024 0.017 0.3046
Trypanosoma cruzi hexose transporter 0.0033 0.035 0.4832
Loa Loa (eye worm) hypothetical protein 0.0019 0.0078 0.0125
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Loa Loa (eye worm) hypothetical protein 0.006 0.0873 0.1408
Leishmania major hypothetical protein, conserved 0.0053 0.0724 1
Echinococcus multilocularis General substrate transporter 0.0092 0.1483 0.1483
Plasmodium vivax proline--tRNA ligase, putative 0.0037 0.0432 0.051
Trichomonas vaginalis conserved hypothetical protein 0.0107 0.1773 1
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0033 0.0342 0.0617
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0032 0.0329 0.0329
Plasmodium vivax hypothetical protein, conserved 0.0163 0.2852 0.3367
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0873 0.0873
Echinococcus multilocularis lysine specific demethylase 6a 0.0053 0.0724 0.0724
Loa Loa (eye worm) jmjC domain-containing protein 0.0053 0.0724 0.1168
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Loa Loa (eye worm) hypothetical protein 0.0053 0.0737 0.1189
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0099
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Trichomonas vaginalis glucose transporter, putative 0.0033 0.035 0.1973
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0173 0.3044 0.3595
Plasmodium falciparum calcium-dependent protein kinase 4 0.0033 0.0342 0.0404
Plasmodium vivax calcium-dependent protein kinase, putative 0.0033 0.0342 0.0404
Leishmania major glucose transporter/membrane transporter D2, putative 0.0033 0.035 0.4832
Trypanosoma cruzi hexose transporter, putative 0.0018 0.006 0.0824
Brugia malayi lysyl-tRNA synthetase 0.0024 0.017 0.017
Plasmodium vivax JmjC domain containing protein 0.0053 0.0724 0.0855
Echinococcus multilocularis lysine specific demethylase 5A 0.0197 0.3513 0.3513
Echinococcus granulosus calcium dependent protein kinase 0.0031 0.0303 0.0303
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0078 0.0078
Echinococcus granulosus JmjC domain containing protein 4 0.0053 0.0724 0.0724
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0037 0.0432 0.5961
Plasmodium falciparum protein kinase 6 0.0453 0.8468 1
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.002 0.0101 1
Brugia malayi PHD-finger family protein 0.0163 0.2852 0.2852
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.017 0.0216
Giardia lamblia Prolyl-tRNA synthetase 0.0032 0.0329 0.1154
Toxoplasma gondii PHD-finger domain-containing protein 0.0163 0.2852 0.5147
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.017 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0873 0.0873
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0035 0.0394 0.0394
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Echinococcus multilocularis lysyl tRNA synthetase 0.0024 0.017 0.017
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0078 0.0078
Brugia malayi jmjC domain containing protein 0.0197 0.3513 0.3513
Schistosoma mansoni glucose transport protein 0.0107 0.1773 0.2249
Loa Loa (eye worm) hypothetical protein 0.0024 0.017 0.0275
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0044 0.0569 0.0722
Echinococcus granulosus metabotropic glutamate receptor 2 0.0033 0.0343 0.0343
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Echinococcus multilocularis peregrin 0.0163 0.2852 0.2852
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0033 0.0343 0.0343
Schistosoma mansoni phosphatidylserine receptor 0.0053 0.0724 0.0918
Brugia malayi PHD-finger family protein 0.0053 0.0737 0.0737
Echinococcus granulosus jumonji domain containing 1A 0.0053 0.0724 0.0724
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0432 0.5857
Brugia malayi Sugar transporter family protein 0.0107 0.1773 0.1773
Trichomonas vaginalis sugar transporter, putative 0.0033 0.035 0.1973
Plasmodium falciparum JmjC domain-containing protein, putative 0.0053 0.0724 0.0855
Brugia malayi F/Y-rich N-terminus family protein 0.0053 0.0737 0.0737
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0053 0.0724 0.1307
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0505 0.0505
Schistosoma mansoni glucose transport protein 0.0107 0.1773 0.2249
Brugia malayi Cam kinase protein 1 0.0033 0.0342 0.0342
Echinococcus multilocularis phd:f box containing protein 0.0053 0.0724 0.0724
Loa Loa (eye worm) jmjC domain-containing protein 0.0053 0.0724 0.1168
Echinococcus granulosus peregrin 0.0163 0.2852 0.2852
Plasmodium vivax hypothetical protein, conserved 0.0053 0.0737 0.087
Schistosoma mansoni protein kinase 0.0033 0.0342 0.0433
Echinococcus granulosus lysyl tRNA synthetase 0.0024 0.017 0.017
Plasmodium falciparum calcium-dependent protein kinase 1 0.0033 0.0342 0.0404
Toxoplasma gondii PHD-finger domain-containing protein 0.0163 0.2852 0.5147
Echinococcus multilocularis GPCR, family 2 0.0019 0.0078 0.0078
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0033 0.0342 0.0551
Toxoplasma gondii lysine-tRNA ligase 0.0024 0.017 0.0308
Loa Loa (eye worm) hypothetical protein 0.0163 0.2852 0.4602
Loa Loa (eye worm) hypothetical protein 0.0053 0.0724 0.1168
Plasmodium falciparum calcium-dependent protein kinase 3 0.0033 0.0342 0.0404
Schistosoma mansoni protein phosphatase 2C 0.0053 0.0724 0.0918
Plasmodium falciparum calcium-dependent protein kinase 5 0.0033 0.0342 0.0404
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0033 0.0342 0.0342
Trichomonas vaginalis CAMK family protein kinase 0.0033 0.0342 0.1927
Loa Loa (eye worm) glutamate receptor 0.0039 0.0465 0.0751
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0037 0.0432 0.5961
Trypanosoma cruzi hexose transporter, putative 0.0033 0.035 0.4832
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.017 0.0216
Toxoplasma gondii facilitative glucose transporter GT1 0.0107 0.1773 0.3201
Echinococcus multilocularis JmjC domain containing protein 4 0.0053 0.0724 0.0724
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Loa Loa (eye worm) jmjC domain-containing protein 0.0336 0.6197 1
Brugia malayi Bromodomain containing protein 0.0163 0.2852 0.2852
Giardia lamblia PHD finger protein 15 0.0163 0.2852 1
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.035 0.4748
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0053 0.0737 0.087
Plasmodium falciparum mitogen-activated protein kinase 2 0.0173 0.3044 0.3595
Schistosoma mansoni hypothetical protein 0.0107 0.1773 0.2249
Loa Loa (eye worm) hypothetical protein 0.0279 0.5096 0.8224
Brugia malayi AF-10 protein 0.0053 0.0737 0.0737
Echinococcus granulosus GPCR family 2 0.0019 0.0078 0.0078
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Plasmodium falciparum proline--tRNA ligase 0.0037 0.0432 0.051
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0329 0.0417
Loa Loa (eye worm) glutamate receptor 0.0015 0.0007 0.0011
Brugia malayi metabotropic glutamate receptor type 2 0.0019 0.0078 0.0078
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0033 0.0342 0.0404
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0033 0.0342 0.0617
Loa Loa (eye worm) sugar transporter 0.0107 0.1773 0.2862
Plasmodium vivax lysine--tRNA ligase, putative 0.0024 0.017 0.0201
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Toxoplasma gondii PHD-finger domain-containing protein 0.0053 0.0737 0.133
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0053 0.0724 1
Echinococcus granulosus lysine specific demethylase 5A 0.0197 0.3513 0.3513
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0053 0.0724 0.0724
Schistosoma mansoni jumonji domain containing protein 0.0423 0.7885 1
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0053 0.0724 0.0918
Trypanosoma cruzi hexose transporter, putative 0.0033 0.035 0.4832
Brugia malayi jmjC domain containing protein 0.0053 0.0724 0.0724
Echinococcus granulosus lysine specific demethylase 6a 0.0053 0.0724 0.0724
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0032 0.0329 0.1855
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0078 0.0078
Schistosoma mansoni jumonji domain containing protein 0.0053 0.0724 0.0918
Trichomonas vaginalis sugar transporter, putative 0.0033 0.035 0.1973
Loa Loa (eye worm) hypothetical protein 0.0053 0.0724 0.1168
Entamoeba histolytica protein kinase, putative 0.0033 0.0342 1
Trypanosoma brucei glucose transporter, putative 0.0033 0.035 0.4748
Schistosoma mansoni jumonji/arid domain-containing protein 0.0197 0.3513 0.4455
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0099
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.017 1
Schistosoma mansoni hypothetical protein 0.0163 0.2852 0.3617
Trichomonas vaginalis sugar transporter, putative 0.0033 0.035 0.1973
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0342 0.0342
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0033 0.0342 0.0617
Loa Loa (eye worm) hypothetical protein 0.0033 0.0342 0.0551
Loa Loa (eye worm) hypothetical protein 0.0041 0.0505 0.0814
Loa Loa (eye worm) jmjC domain-containing protein 0.0197 0.3513 0.5668
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.002 0.0101 1
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0053 0.0737 1
Chlamydia trachomatis lysine--tRNA ligase 0.0024 0.017 0.5
Onchocerca volvulus Alhambra homolog 0.0163 0.2852 1
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0033 0.0342 0.0404
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0873 0.1408
Loa Loa (eye worm) hypothetical protein 0.0032 0.0329 0.0531
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0107 0.1773 0.1773
Echinococcus multilocularis jumonji domain containing protein 0.0226 0.4082 0.4082
Plasmodium vivax CDK-related protein kinase 6, putative 0.0453 0.8468 1
Plasmodium falciparum lysine--tRNA ligase 0.0024 0.017 0.0201
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0053 0.0724 0.9826
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0163 0.2852 0.3617
Toxoplasma gondii protein kinase, putative 0.0302 0.554 1
Echinococcus granulosus phd:f box containing protein 0.0053 0.0724 0.0724
Leishmania major lysyl-tRNA synthetase, putative 0.0024 0.017 0.2355
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0329 0.0417
Plasmodium vivax hexose transporter 0.0107 0.1773 0.2094
Echinococcus multilocularis PHD finger protein rhinoceros 0.0163 0.2852 0.2852
Echinococcus granulosus jumonji domain containing protein 0.0226 0.4082 0.4082
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.035 0.4748
Schistosoma mansoni hypothetical protein 0.0053 0.0737 0.0934
Schistosoma mansoni jumonji/arid domain-containing protein 0.0197 0.3513 0.4455
Schistosoma mansoni glucose transport protein 0.0107 0.1773 0.2249
Echinococcus granulosus PHD finger protein rhinoceros 0.0163 0.2852 0.2852
Leishmania major glucose transporter, lmgt2 0.0033 0.035 0.4832
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0033 0.0342 0.0404

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 4.1475 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) 6.3096 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 23.7781 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) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 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) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) = 100 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

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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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