Detailed information for compound 334481

Basic information

Technical information
  • TDR Targets ID: 334481
  • Name: (2S)-2-[[4-[3-(2-amino-4-oxo-1,7-dihydropyrro lo[2,3-d]pyrimidin-6-yl)propyl]benzoyl]amino] pentanedioic acid
  • MW: 441.437 | Formula: C21H23N5O6
  • H donors: 6 H acceptors: 6 LogP: 0.61 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 2
  • SMILES: OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)CCCc1[nH]c2c(c1)c(=O)[nH]c(n2)N
  • InChi: 1S/C21H23N5O6/c22-21-25-17-14(19(30)26-21)10-13(23-17)3-1-2-11-4-6-12(7-5-11)18(29)24-15(20(31)32)8-9-16(27)28/h4-7,10,15H,1-3,8-9H2,(H,24,29)(H,27,28)(H,31,32)(H4,22,23,25,26,30)/t15-/m0/s1
  • InChiKey: QLSVPQAGJDLITE-HNNXBMFYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2S)-2-[[[4-[3-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)propyl]phenyl]-oxomethyl]amino]pentanedioic acid
  • (2S)-2-[[4-[3-(2-azanyl-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)propyl]phenyl]carbonylamino]pentanedioic acid
  • (2S)-2-[[4-[3-(2-amino-4-keto-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)propyl]benzoyl]amino]glutaric acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus phosphoribosylglycinamide formyltransferase Starlite/ChEMBL References
Homo sapiens thymidylate synthetase Starlite/ChEMBL References
Homo sapiens phosphoribosylglycinamide formyltransferase, phosphoribosylglycinamide synthetase, phosphoribosylaminoimidazole synthetase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium tuberculosis Probable phosphoribosylformylglycinamidine CYCLO-ligase PurM (AIRS) (phosphoribosyl-aminoimidazole synthetase) (air synthase) Get druggable targets OG5_126894 All targets in OG5_126894
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Leishmania donovani dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Leishmania mexicana dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Plasmodium yoelii thymidylate synthase, putative Get druggable targets OG5_127385 All targets in OG5_127385
Babesia bovis dihydrofolate reductase/thymidilate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) Get druggable targets OG5_127385 All targets in OG5_127385
Candida albicans purine biosynthesis Get druggable targets OG5_126894 All targets in OG5_126894
Cryptosporidium parvum dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127385 All targets in OG5_127385
Leishmania braziliensis dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Plasmodium knowlesi bifunctional dihydrofolate reductase-thymidylate synthase, putative Get druggable targets OG5_127385 All targets in OG5_127385
Trypanosoma brucei gambiense dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium leprae PROBABLE PHOSPHORIBOSYLAMINE--GLYCINE LIGASE PURD (GARS) (GLYCINAMIDE RIBONUCLEOTIDE SYNTHETASE) (PHOSPHORIBOSYLGLYCINAMIDE SYNT Get druggable targets OG5_126894 All targets in OG5_126894
Candida albicans N terminus of ADE5,7 bifunctional ligase Get druggable targets OG5_126894 All targets in OG5_126894
Schistosoma japonicum ko:K00560 thymidylate synthase [EC2.1.1.45], putative Get druggable targets OG5_127385 All targets in OG5_127385
Theileria parva dihydrofolate reductase-thymidylate synthase, putative Get druggable targets OG5_127385 All targets in OG5_127385
Plasmodium berghei bifunctional dihydrofolate reductase-thymidylate synthase, putative Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium ulcerans phosphoribosylamine--glycine ligase Get druggable targets OG5_126894 All targets in OG5_126894
Mycobacterium leprae PROBABLE PHOSPHORIBOSYLFORMYLGLYCINAMIDINE CYCLO-LIGASE PURM (AIRS) (PHOSPHORIBOSYL-AMINOIMIDAZOLE SYNTHETASE) (AIR SYNTHASE) Get druggable targets OG5_126894 All targets in OG5_126894
Mycobacterium ulcerans phosphoribosylaminoimidazole synthetase Get druggable targets OG5_126894 All targets in OG5_126894
Onchocerca volvulus Get druggable targets OG5_127385 All targets in OG5_127385
Cryptosporidium hominis chain A, crystal structure of Dhfr Get druggable targets OG5_127385 All targets in OG5_127385
Onchocerca volvulus Get druggable targets OG5_126894 All targets in OG5_126894
Leishmania major dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Loa Loa (eye worm) thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium ulcerans thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Wolbachia endosymbiont of Brugia malayi phosphoribosylaminoimidazole synthetase Get druggable targets OG5_126894 All targets in OG5_126894
Candida albicans Thymidylate synthase capable of functional substitution for S. cerevisiae CDC21 (YOR074C) Get druggable targets OG5_127385 All targets in OG5_127385
Mycobacterium tuberculosis Probable phosphoribosylamine--glycine ligase PurD (GARS) (glycinamide ribonucleotide synthetase) (phosphoribosylglycinamide synt Get druggable targets OG5_126894 All targets in OG5_126894
Echinococcus multilocularis thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Neospora caninum Bifunctional dihydrofolate reductase-thymidylate synthase, related Get druggable targets OG5_127385 All targets in OG5_127385
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Onchocerca volvulus Get druggable targets OG5_126894 All targets in OG5_126894
Brugia malayi thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Leishmania infantum dihydrofolate reductase-thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Wolbachia endosymbiont of Brugia malayi phosphoribosylamine--glycine ligase Get druggable targets OG5_126894 All targets in OG5_126894
Candida albicans ADE5,7 bifunctional ligase Get druggable targets OG5_126894 All targets in OG5_126894
Candida albicans Thymidylate synthase capable of functional substitution for S. cerevisiae CDC21 (YOR074C) Get druggable targets OG5_127385 All targets in OG5_127385
Echinococcus granulosus thymidylate synthase Get druggable targets OG5_127385 All targets in OG5_127385
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative Get druggable targets OG5_127385 All targets in OG5_127385
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
Onchocerca volvulus 0.0195 0.4115 0.4375
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0099 0.0713 0.0269
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Mycobacterium tuberculosis Hypothetical protein 0.0093 0.0473 0.0503
Onchocerca volvulus 0.0343 0.9407 1
Leishmania major prostaglandin f synthase, putative 0.0343 0.9407 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase 0.0343 0.9407 1
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0195 0.4115 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Trypanosoma cruzi aldo/keto reductase, putative 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase 0.0343 0.9407 1
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0195 0.4115 0.4375
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 0.3913
Loa Loa (eye worm) thymidylate synthase 0.0195 0.4115 0.3913
Echinococcus multilocularis aldo keto reductase 0.0343 0.9407 1
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0343 0.9407 1
Loa Loa (eye worm) oxidoreductase 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0099 0.0713 0.0269
Loa Loa (eye worm) oxidoreductase 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Onchocerca volvulus 0.0343 0.9407 1
Brugia malayi thymidylate synthase 0.0195 0.4115 0.4077
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0099 0.0713 0.0269
Loa Loa (eye worm) oxidoreductase 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Echinococcus multilocularis thymidylate synthase 0.0195 0.4115 0.3913
Onchocerca volvulus 0.0343 0.9407 1
Mycobacterium leprae Possible oxidoreductase 0.0099 0.0713 0.0713
Wolbachia endosymbiont of Brugia malayi phosphoribosylamine--glycine ligase 0.0359 1 1
Mycobacterium ulcerans thymidylate synthase 0.0195 0.4115 0.4115
Mycobacterium leprae Conserved hypothetical protein 0.0244 0.5862 0.5862
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0343 0.9407 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0343 0.9407 1
Onchocerca volvulus 0.0343 0.9407 1
Schistosoma mansoni pol-related 0.0343 0.9407 1
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0099 0.0713 0.0269
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0099 0.0713 0.0269
Echinococcus multilocularis aldo keto reductase 0.0343 0.9407 1
Entamoeba histolytica aldose reductase, putative 0.0343 0.9407 1
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0195 0.4115 0.4115
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Mycobacterium ulcerans hypothetical protein 0.0099 0.0713 0.0713
Leishmania major aldo-keto reductase-like protein 0.0343 0.9407 1
Echinococcus granulosus aldehyde reductase 0.0244 0.5862 0.5922
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 0.3913
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 1
Trypanosoma cruzi aldo-keto reductase 0.0343 0.9407 1
Trypanosoma cruzi aldo/keto reductase, putative 0.0099 0.0713 0.0269
Echinococcus granulosus thymidylate synthase 0.0195 0.4115 0.3913
Giardia lamblia Aldose reductase 0.0343 0.9407 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 0.4077
Entamoeba histolytica aldose reductase, putative 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Toxoplasma gondii aldose reductase, putative 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0343 0.9407 1
Trichomonas vaginalis conserved hypothetical protein 0.0099 0.0713 0.0269
Echinococcus granulosus aldo keto reductase 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Loa Loa (eye worm) oxidoreductase 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Mycobacterium ulcerans phosphoribosylamine--glycine ligase 0.0359 1 1
Schistosoma mansoni aldo-keto reductase 0.0343 0.9407 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0343 0.9407 1
Echinococcus multilocularis aldehyde reductase 0.0244 0.5862 0.5922
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase 0.0343 0.9407 1
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 0.3913
Trypanosoma brucei prostaglandin f synthase 0.0343 0.9407 1
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0343 0.9407 0.9407
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Mycobacterium ulcerans oxidoreductase 0.0343 0.9407 0.9407
Onchocerca volvulus 0.0099 0.0713 0.0758
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Giardia lamblia Aldose reductase 0.0343 0.9407 0.5
Echinococcus multilocularis aldo keto reductase 0.0343 0.9407 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0343 0.9407 1
Echinococcus granulosus hypothetical protein 0.0343 0.9407 1
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0195 0.4115 0.3913
Mycobacterium tuberculosis Conserved protein 0.0099 0.0713 0.0758
Schistosoma mansoni aldo-keto reductase 0.0343 0.9407 1
Trypanosoma brucei aldo-keto reductase, putative 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Onchocerca volvulus 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Onchocerca volvulus 0.0343 0.9407 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0343 0.9407 1
Loa Loa (eye worm) oxidoreductase 0.0343 0.9407 1
Brugia malayi NADH-dependent xylose reductase 0.0099 0.0713 0.0269
Loa Loa (eye worm) hypothetical protein 0.0343 0.9407 1
Entamoeba histolytica aldose reductase, putative 0.0343 0.9407 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0343 0.9407 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0343 0.9407 1

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) Displacement of [3H]folic acid from human FRbeta in Chinese hamster D4 cells ChEMBL. 18680275
Activity (binding) Displacement of [3H]folic acid from human FRalpha in Chinese hamster RT16 cells ChEMBL. 18680275
EC50 (functional) = 460 nM Growth inhibitory activity of the compound against CCRF-CEM human lymphoblastic leukemia cells ChEMBL. 16078850
EC50 (functional) = 460 nM Growth inhibitory activity of the compound against CCRF-CEM human lymphoblastic leukemia cells ChEMBL. 16078850
EC50 (functional) = 470 nM Growth inhibitory activity of the compound against MTX resistant CCRF-CEM human lymphoblastic leukemia cells with decreased polyglutamylation ChEMBL. 16078850
EC50 (functional) = 470 nM Growth inhibitory activity of the compound against MTX resistant CCRF-CEM human lymphoblastic leukemia cells with decreased polyglutamylation ChEMBL. 16078850
EC50 (functional) = 860 nM Growth inhibitory activity of the compound against MTX resistant subline of CCRF-CEM human lymphoblastic leukemia cells ChEMBL. 16078850
EC50 (functional) = 860 nM Growth inhibitory activity of the compound against MTX resistant subline of CCRF-CEM human lymphoblastic leukemia cells ChEMBL. 16078850
EC50 (functional) = 4350 nM Growth inhibitory activity of the compound against resistant CCRF-CEM human lymphoblastic leukemia cells with decreased uptake of MTX ChEMBL. 16078850
EC50 (functional) = 4350 nM Growth inhibitory activity of the compound against resistant CCRF-CEM human lymphoblastic leukemia cells with decreased uptake of MTX ChEMBL. 16078850
IC50 (functional) = 1.7 nM Antiproliferative activity against human RFC and FRalpha expressing human KB cells ChEMBL. 18680275
IC50 (functional) = 2.2 nM Antiproliferative activity against human RFC and FRalpha expressing human IGROV1 cells ChEMBL. 18680275
IC50 (binding) = 18 nM Inhibition of GARFTase in human KB cells assessed as inhibition of [14C]glycine incorporation into [14C]formylGAR in presence of azaserine ChEMBL. 18680275
IC50 (functional) = 23 nM Growth inhibition of Chinese hamster R2 cells expressing human PCFT4 after 96 hrs by CellTiter-blue assay ChEMBL. 24111942
IC50 (functional) = 448 nM Antiproliferative activity against human RFC expressing Chinese hamster R2 cells ChEMBL. 18680275
IC50 (functional) > 1000 nM Antiproliferative activity against human RFC and FRalpha expressing human KB cells in presence of folic acid ChEMBL. 18680275
IC50 (functional) > 1000 nM Antiproliferative activity against human RFC and FRalpha expressing human IGROV1 cells in presence of folic acid ChEMBL. 18680275
IC50 (functional) > 1000 nM Cytotoxicity against chinese hamster R2 cells after 96 hrs by CellTitre-Blue fluorescence assay ChEMBL. 24256410
IC50 (binding) = 2.44 uM Inhibition of mouse recombinant GARFTase ChEMBL. 18680275
IC50 (binding) > 17 uM Inhibition of human thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 17 uM Inhibition of human thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) = 22 uM Inhibition of Escherichia coli dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) = 22 uM Inhibition of Escherichia coli dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 24 uM Inhibition of human dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 24 uM Inhibition of human dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 100 uM Inhibition of Lactobacillus casei thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 100 uM Inhibition of Lactobacillus casei thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 110 uM Inhibition of Lactobacillus casei dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 110 uM Inhibition of Lactobacillus casei dihydrofolate reductase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 180 uM Inhibition of Escherichia coli thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
IC50 (binding) > 180 uM Inhibition of Escherichia coli thymidylate synthetase at 37 degree C pH 7.4 ChEMBL. 16078850
Inhibition (binding) < 20 % Inhibition of human RFC-mediated [3H]MTX transport expressed in Chinese hamster PC43-10 cells ChEMBL. 18680275
Km (ADMET) = 0.9 Km of the compound (FPGS substrate activity) for recombinant human FPGS ChEMBL. 16078850
Ratio (ADMET) = 0.63 Ratio of Vmax, rel to Km of the compound (FPGS substrate activity) for recombinant human FPGS ChEMBL. 16078850
Vmax rel (ADMET) = 0.57 Vmax, rel of the compound (FPGS substrate activity) for recombinant human FPGS ChEMBL. 16078850

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 16078850

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

2 literature references were collected for this gene.

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