Detailed information for compound 1415925

Basic information

Technical information
  • TDR Targets ID: 1415925
  • Name: N-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)met hyl]-N-(thiophen-2-ylmethyl)furan-2-carboxami de
  • MW: 403.457 | Formula: C21H17N5O2S
  • H donors: 0 H acceptors: 4 LogP: 3.57 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc2c(c1)cc(c1n2nnn1)CN(C(=O)c1ccco1)Cc1cccs1
  • InChi: 1S/C21H17N5O2S/c1-14-6-7-18-15(10-14)11-16(20-22-23-24-26(18)20)12-25(13-17-4-3-9-29-17)21(27)19-5-2-8-28-19/h2-11H,12-13H2,1H3
  • InChiKey: NEYCEAIAAOVHRP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]-N-(2-thienylmethyl)furan-2-carboxamide
  • N-[(7-methyl-4-tetrazolo[1,5-a]quinolinyl)methyl]-N-(2-thienylmethyl)-2-furancarboxamide
  • N-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]-N-(2-thienylmethyl)-2-furamide
  • N-[(7-methyl-[1,2,3,4]tetrazolo[1,5-a]quinolin-4-yl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
  • Furan-2-carboxylic acid (7-methyl-1,2,3,9b-tetraaza-cyclopenta[a]naphthalen-4-ylmethyl)-thiophen-2-ylmethyl-amide
  • MLS000032764
  • SMR000006121
  • ASN 06118202
  • ZINC01376999

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Trypanosoma brucei phosphoglycerate kinase Starlite/ChEMBL No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens thyroid stimulating hormone receptor Starlite/ChEMBL No references
Trypanosoma brucei gambiense phosphoglycerate kinase, putative No references
Homo sapiens neuropeptide S receptor 1 Starlite/ChEMBL No references
Homo sapiens polo-like kinase 1 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania braziliensis PGKC, phosphoglycerate kinase C Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma brucei gambiense phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma brucei phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Plasmodium falciparum phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania infantum phosphoglycerate kinase B, cytosolic Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Cryptosporidium hominis phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Plasmodium knowlesi phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum ko:K00927 phosphoglycerate kinase [EC2.7.2.3], putative Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma congolense phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma congolense phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania mexicana phosphoglycerate kinase C, glycosomal Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania mexicana phosphoglycerate kinase B, cytosolic Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania braziliensis protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania donovani phosphoglycerate kinase C, glycosomal Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma congolense phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei polo-like protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus granulosus phosphoglycerate kinase 1 Get druggable targets OG5_126776 All targets in OG5_126776
Toxoplasma gondii phosphoglycerate kinase PGKI Get druggable targets OG5_126776 All targets in OG5_126776
Loa Loa (eye worm) PLK/PLK1 protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Kinase, PLK Get druggable targets OG5_127396 All targets in OG5_127396
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Entamoeba histolytica phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Neospora caninum Phosphoglycerate kinase (EC 2.7.2.3), related Get druggable targets OG5_126776 All targets in OG5_126776
Toxoplasma gondii phosphoglycerate kinase PGKII Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania major phosphoglycerate kinase C, glycosomal Get druggable targets OG5_126776 All targets in OG5_126776
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Get druggable targets OG5_136011 All targets in OG5_136011
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei gambiense polo-like protein kinase,protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Schistosoma japonicum ko:K06631 polo-like kinase 1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus multilocularis phosphoglycerate kinase 1 Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania infantum protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi serine/threonine-protein kinase plk-2 Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Serine/threonine-protein kinase PLK1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Plasmodium vivax phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Plasmodium berghei phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma cruzi phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus multilocularis serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Mycobacterium leprae Probable phosphoglycerate kinase Pgk Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus granulosus neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Entamoeba histolytica serine/threonine protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania mexicana protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Theileria parva phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Mycobacterium ulcerans phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Babesia bovis phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania major protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Chlamydia trachomatis phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Onchocerca volvulus Serine\/threonine kinase homolog Get druggable targets OG5_127396 All targets in OG5_127396
Cryptosporidium parvum phosphoglycerate kinase 1 Get druggable targets OG5_126776 All targets in OG5_126776
Neospora caninum hypothetical protein Get druggable targets OG5_126776 All targets in OG5_126776
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk Get druggable targets OG5_126776 All targets in OG5_126776
Candida albicans 3-phosphoglycerate kinase similar to S. cerevisiae PGK1 (YCR012W) Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Brugia malayi Phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Echinococcus multilocularis neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Brugia malayi follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Leishmania major phosphoglycerate kinase B, cytosolic Get druggable targets OG5_126776 All targets in OG5_126776
Treponema pallidum phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trypanosoma cruzi phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei gambiense phosphoglycerate kinase, putative Get druggable targets OG5_126776 All targets in OG5_126776
Leishmania infantum phosphoglycerate kinase C, glycosomal Get druggable targets OG5_126776 All targets in OG5_126776
Candida albicans 3-phosphoglycerate kinase similar to S. cerevisiae PGK1 (YCR012W) Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Echinococcus multilocularis neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Plasmodium yoelii phosphoglycerate kinase Get druggable targets OG5_126776 All targets in OG5_126776
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus granulosus serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus Putative endochitinase 0.0175 0.2499 0.637
Loa Loa (eye worm) chitinase I 0.0157 0.2132 0.4647
Plasmodium vivax hypothetical protein, conserved 0.0249 0.3924 1
Brugia malayi Protein kinase domain containing protein 0.0102 0.1065 0.2321
Echinococcus multilocularis neuropeptide receptor A26 0.056 1 1
Echinococcus granulosus phosphoglycerate kinase 1 0.0206 0.3086 0.2549
Leishmania major phosphoglycerate kinase C, glycosomal 0.0206 0.3086 1
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0283 0.4587 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.0115 0.1314 0.3349
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Brugia malayi endochitinase 0.0157 0.2132 0.4647
Schistosoma mansoni serine/threonine protein kinase 0.0102 0.1065 0.2279
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0102 0.1065 0.2027
Echinococcus multilocularis neuropeptide s receptor 0.056 1 1
Echinococcus multilocularis dual specificity 0.0102 0.1065 0.0371
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0206 0.3086 1
Echinococcus multilocularis Hepatocellular carcinoma associated antigen 59 0.0249 0.3924 0.3452
Leishmania major chitinase 0.0157 0.2132 0.6235
Toxoplasma gondii hypothetical protein 0.0249 0.3924 1
Loa Loa (eye worm) hypothetical protein 0.0101 0.1047 0.2283
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Onchocerca volvulus 0.0249 0.3924 1
Entamoeba histolytica chitinase, putative 0.0157 0.2132 0.5278
Brugia malayi Phosphoglycerate kinase 0.0075 0.0551 0.1201
Trypanosoma brucei phosphoglycerate kinase 0.0206 0.3086 1
Echinococcus granulosus Hepatocellular carcinoma associated antigen 59 0.0249 0.3924 0.3452
Loa Loa (eye worm) hypothetical protein 0.0101 0.1047 0.2283
Onchocerca volvulus Putative endochitinase 0.0175 0.2499 0.637
Echinococcus granulosus dual specificity 0.0102 0.1065 0.0371
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0206 0.3086 0.5
Brugia malayi serine/threonine-protein kinase plk-2 0.0115 0.1314 0.2865
Mycobacterium ulcerans phosphoglycerate kinase 0.0206 0.3086 1
Brugia malayi Endochitinase 0.0175 0.2499 0.5449
Schistosoma mansoni hypothetical protein 0.0249 0.3924 1
Treponema pallidum phosphoglycerate kinase 0.0206 0.3086 0.5
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0115 0.1314 0.301
Onchocerca volvulus Putative endochitinase 0.0157 0.2132 0.5432
Trypanosoma brucei polo-like protein kinase 0.0115 0.1314 0.301
Schistosoma mansoni phosphoglycerate kinase 0.0206 0.3086 0.7737
Brugia malayi Phosphoglycerate kinase 0.0206 0.3086 0.6727
Echinococcus multilocularis phosphoglycerate kinase 1 0.0206 0.3086 0.2549
Schistosoma mansoni hypothetical protein 0.0205 0.3068 0.769
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0102 0.1065 0.2027
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Plasmodium falciparum conserved protein, unknown function 0.0249 0.3924 1
Schistosoma mansoni hypothetical protein 0.0205 0.3068 0.769
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.072 0.1571
Schistosoma mansoni chromobox protein 0.0084 0.072 0.1349
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0102 0.1065 0.2027
Brugia malayi follicle stimulating hormone receptor 0.0283 0.4587 1
Loa Loa (eye worm) hypothetical protein 0.0249 0.3924 0.8554
Trypanosoma brucei phosphoglycerate kinase 0.0206 0.3086 1
Trichomonas vaginalis chromobox protein, putative 0.0051 0.007 0.0226
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.0102 0.1065 0.2321
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0115 0.1314 0.064
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0115 0.1314 0.2865
Trichomonas vaginalis CAMK family protein kinase 0.0057 0.0192 0.0621
Loa Loa (eye worm) hypothetical protein 0.0249 0.3924 0.8554
Schistosoma mansoni phosphoglycerate kinase 0.0206 0.3086 0.7737
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0206 0.3086 0.5
Echinococcus granulosus neuropeptide receptor A26 0.056 1 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0115 0.1314 0.301
Chlamydia trachomatis phosphoglycerate kinase 0.0206 0.3086 0.5
Echinococcus granulosus geminin 0.0205 0.3068 0.253
Trypanosoma cruzi polo-like protein kinase, putative 0.0115 0.1314 0.301
Entamoeba histolytica phosphoglycerate kinase, putative 0.0206 0.3086 1
Loa Loa (eye worm) cuticular endochitinase 0.0157 0.2132 0.4647
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0115 0.1314 0.064
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0206 0.3086 1
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.0102 0.1065 0.2027
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0206 0.3086 1
Onchocerca volvulus 0.0249 0.3924 1
Loa Loa (eye worm) hypothetical protein 0.0133 0.1682 0.3667
Brugia malayi endochitinase 0.0175 0.2499 0.5449
Schistosoma mansoni serine/threonine protein kinase 0.0115 0.1314 0.2952
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Onchocerca volvulus Putative endochitinase 0.0175 0.2499 0.637
Giardia lamblia Phosphoglycerate kinase 0.0206 0.3086 1
Trichomonas vaginalis CAMK family protein kinase 0.0057 0.0192 0.0621
Onchocerca volvulus Putative endochitinase 0.0157 0.2132 0.5432
Brugia malayi Heterochromatin protein 1 0.0084 0.072 0.1571
Schistosoma mansoni chromobox protein 0.0084 0.072 0.1349
Brugia malayi Hepatocellular carcinoma-associated antigen 59 family protein 0.0249 0.3924 0.8554
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0206 0.3086 1
Loa Loa (eye worm) microfilarial chitinase 0.0152 0.205 0.4469
Trichomonas vaginalis chromobox protein, putative 0.0084 0.072 0.2335
Loa Loa (eye worm) hypothetical protein 0.0206 0.3086 0.6727
Trichomonas vaginalis CAMK family protein kinase 0.0115 0.1314 0.4258
Leishmania major phosphoglycerate kinase B, cytosolic 0.0206 0.3086 1
Trichomonas vaginalis chromobox protein, putative 0.0084 0.072 0.2335
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0206 0.3086 1
Trichomonas vaginalis chromobox protein, putative 0.0051 0.007 0.0226
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.007 0.0178
Entamoeba histolytica serine/threonine protein kinase, putative 0.0115 0.1314 0.1233
Echinococcus multilocularis geminin 0.0205 0.3068 0.253

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.3294 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 0.7079 uM PUBCHEM_BIOASSAY: qHTS Assay to Find Inhibitors of Phosphoglycerate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.9433 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 8.4368 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) 10 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.9953 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.3535 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) 22.3872 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 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) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 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) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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.
 
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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