Detailed information for compound 1310632

Basic information

Technical information
  • TDR Targets ID: 1310632
  • Name: 2-(4-methoxyphenyl)-N-(4-pyridin-3-yl-1,3-thi azol-2-yl)acetamide
  • MW: 325.385 | Formula: C17H15N3O2S
  • H donors: 1 H acceptors: 3 LogP: 2.62 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)CC(=O)Nc1scc(n1)c1cccnc1
  • InChi: 1S/C17H15N3O2S/c1-22-14-6-4-12(5-7-14)9-16(21)20-17-19-15(11-23-17)13-3-2-8-18-10-13/h2-8,10-11H,9H2,1H3,(H,19,20,21)
  • InChiKey: LCKIMIQTFZKZTB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(4-methoxyphenyl)-N-[4-(3-pyridyl)thiazol-2-yl]acetamide
  • 2-(4-methoxyphenyl)-N-[4-(3-pyridyl)-2-thiazolyl]acetamide
  • 2-(4-methoxyphenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)ethanamide
  • MLS000394496
  • SMR000261945
  • T5252372

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens Rap guanine nucleotide exchange factor (GEF) 3 Starlite/ChEMBL No references
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131726 All targets in OG5_131726
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi N-terminal motif family protein Get druggable targets OG5_131726 All targets in OG5_131726
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog Get druggable targets OG5_131726 All targets in OG5_131726
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
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
Loa Loa (eye worm) hypothetical protein 0.1296 0.7831 0.7831
Echinococcus multilocularis FTZ F1 alpha 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0146 0.0842 0.084
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Echinococcus granulosus Nuclear hormone receptor HR96 0.0035 0.0168 0.0165
Entamoeba histolytica hypothetical protein 0.0043 0.022 0.0217
Entamoeba histolytica hexokinase 2 0.1653 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0028 0.0026
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0008 0.0002 0.0002
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0028 0.0008
Schistosoma mansoni dep domain containing protein 0.0011 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Loa Loa (eye worm) DR-78 0.0035 0.0168 0.0165
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0028 0.0026
Plasmodium falciparum hexokinase 0.1653 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Trypanosoma brucei hexokinase 0.1653 1 1
Brugia malayi ecdysone receptor 0.0035 0.0168 0.0165
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0074 0.0405 0.0403
Echinococcus multilocularis thyroid hormone receptor alpha 0.0074 0.0405 0.0403
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0039 0.0193 0.0191
Loa Loa (eye worm) nuclear hormone receptor 0.0035 0.0168 0.0165
Echinococcus granulosus nuclear receptor nhr 48 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0011 0.0021 0.0019
Echinococcus granulosus FTZ F1 alpha 0.0074 0.0405 0.0403
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0074 0.0405 0.0405
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0074 0.0405 0.0403
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Schistosoma mansoni thyroid hormone receptor 0.0074 0.0405 0.0405
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0011 0.0021 0.0019
Loa Loa (eye worm) hexokinase 0.1037 0.6257 0.6256
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0074 0.0405 0.0403
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0035 0.0168 0.0165
Brugia malayi hypothetical protein 0.0039 0.0193 0.0191
Loa Loa (eye worm) nuclear receptor nhr-7B 0.1331 0.8043 0.8042
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0074 0.0405 0.0403
Brugia malayi nuclear receptor NHR-88 0.0035 0.0168 0.0165
Echinococcus multilocularis nuclear receptor nhr 48 0.0035 0.0168 0.0165
Loa Loa (eye worm) RecQ helicase 0.0029 0.0132 0.013
Echinococcus multilocularis regulator of G protein signaling 7 0.0011 0.0021 0.0019
Schistosoma mansoni dishevelled 0.0011 0.0021 0.0021
Echinococcus granulosus regulator of G protein signaling 7 0.0011 0.0021 0.0019
Schistosoma mansoni nuclear receptor 0.0035 0.0168 0.0168
Echinococcus granulosus hexokinase 0.1653 1 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0035 0.0168 0.0165
Loa Loa (eye worm) DIX domain-containing protein 0.0011 0.0021 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0074 0.0405 0.0403
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.005 0.0048
Brugia malayi regulator of G-protein signaling egl-10 0.0011 0.0021 0.0019
Echinococcus multilocularis ecdysone induced protein 78C 0.0074 0.0405 0.0403
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0011 0.0021 0.0019
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0074 0.0405 0.0403
Brugia malayi Hexokinase family protein 0.1653 1 1
Brugia malayi ecdysteroid receptor 0.0074 0.0405 0.0403
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.022 0.0217
Brugia malayi N-terminal motif family protein 0.0218 0.128 0.1278
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0011 0.0021 0.0021
Treponema pallidum hexokinase (hxk) 0.1653 1 0.5
Plasmodium vivax hexokinase, putative 0.1653 1 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0074 0.0405 0.0403
Brugia malayi Hexokinase family protein 0.1037 0.6257 0.6256
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0074 0.0405 0.0403
Brugia malayi orphan nuclear receptor NR2E1 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0039 0.0193 0.0191
Brugia malayi hypothetical protein 0.0011 0.0021 0.0019
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0035 0.0168 0.0165
Onchocerca volvulus 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0011 0.0021 0.0019
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0074 0.0405 0.0403
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0073 0.0053
Echinococcus multilocularis bloom syndrome protein 0.0029 0.0132 0.013
Loa Loa (eye worm) hypothetical protein 0.0039 0.0193 0.0191
Leishmania major hexokinase, putative 0.1653 1 1
Schistosoma mansoni RAR-like nuclear receptor 0.0074 0.0405 0.0405
Echinococcus multilocularis segment polarity protein dishevelled 0.0011 0.0021 0.0019
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.022 0.022
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0074 0.0405 0.0403
Schistosoma mansoni nuclear hormone receptor 0.0035 0.0168 0.0168
Onchocerca volvulus 0.1653 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0039 0.0193 0.0193
Onchocerca volvulus 0.0011 0.0021 0.0019
Brugia malayi nuclear receptor RXR 0.0039 0.0193 0.0191
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.0132 0.013
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0074 0.0405 0.0403
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0074 0.0405 0.0405
Schistosoma mansoni hypothetical protein 0.0043 0.022 0.022
Echinococcus granulosus hexokinase 0.1653 1 1
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0011 0.0021 0.0019
Brugia malayi steroid hormone receptor 0.0074 0.0405 0.0403
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0074 0.0405 0.0403
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0035 0.0168 0.0165
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0074 0.0405 0.0405
Onchocerca volvulus 0.1653 1 1
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0035 0.0168 0.0168
Trypanosoma cruzi hexokinase, putative 0.1653 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0074 0.0405 0.0403
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0011 0.0021 0.0019
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0012 0.0028 0.0026
Brugia malayi nuclear receptor NHR-88 0.0074 0.0405 0.0403
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0039 0.0193 0.0191
Leishmania major hexokinase, putative 0.1653 1 1
Schistosoma mansoni DNA helicase recq5 0.0012 0.0028 0.0028
Brugia malayi hypothetical protein 0.0035 0.0168 0.0165
Echinococcus granulosus segment polarity protein dishevelled 0.0011 0.0021 0.0019
Schistosoma mansoni nuclear receptor 0.0035 0.0168 0.0168
Onchocerca volvulus Protein ultraspiracle homolog 0.0074 0.0405 0.0403
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0012 0.0028 0.0026
Schistosoma mansoni nuclear hormone receptor 0.0035 0.0168 0.0168
Schistosoma mansoni retinoic acid receptor RXR 0.0074 0.0405 0.0405
Loa Loa (eye worm) nuclear receptor NHR-67 0.0035 0.0168 0.0165
Brugia malayi DIX domain containing protein 0.0011 0.0021 0.0019
Entamoeba histolytica recQ family helicase, putative 0.0015 0.005 0.0048
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.0095 0.0095
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0028 0.0008
Onchocerca volvulus Bile acid receptor homolog 0.0074 0.0405 0.0403
Trypanosoma brucei hexokinase, putative 0.1653 1 1
Echinococcus granulosus bloom syndrome protein 0.0029 0.0132 0.013
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0111 0.0082
Brugia malayi Nuclear hormone receptor E75 0.0035 0.0168 0.0165
Brugia malayi Hexokinase family protein 0.0512 0.3064 0.3062
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Echinococcus multilocularis hexokinase 0.1653 1 1
Schistosoma mansoni hexokinase 0.1653 1 1
Brugia malayi hypothetical protein 0.0035 0.0168 0.0165
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0074 0.0405 0.0403
Brugia malayi hypothetical protein 0.0039 0.0193 0.0191
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0035 0.0168 0.0165
Loa Loa (eye worm) hexokinase 0.1653 1 1
Brugia malayi nuclear hormone receptor family member odr-7 0.0035 0.0168 0.0165
Onchocerca volvulus 0.1037 0.6257 0.6256
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0074 0.0405 0.0403
Schistosoma mansoni nuclear hormone receptor 0.0074 0.0405 0.0405
Brugia malayi hypothetical protein 0.0011 0.0021 0.0019
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Echinococcus granulosus Nuclear hormone receptor HR96 0.0035 0.0168 0.0165
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0074 0.0405 0.0403
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.0132 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0021 0.0019
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0218 0.128 0.1278
Echinococcus granulosus hexokinase type 2 0.1653 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0074 0.0405 0.0403
Echinococcus granulosus hexokinase 0.1653 1 1
Brugia malayi conserved hypotetical protein 0.0035 0.0168 0.0165
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0035 0.0168 0.0165
Brugia malayi Nuclear hormone receptor E75 0.0035 0.0168 0.0165
Echinococcus granulosus thyroid hormone receptor alpha 0.0035 0.0168 0.0165
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0011 0.0021 0.0019
Onchocerca volvulus 0.0035 0.0168 0.0165
Onchocerca volvulus Hexokinase homolog 0.1037 0.6257 0.6256
Brugia malayi nuclear hormone receptor family member nhr-6 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Brugia malayi nuclear hormone receptor 0.1331 0.8043 0.8042
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0035 0.0168 0.0168
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0074 0.0405 0.0403
Brugia malayi hypothetical protein 0.0043 0.022 0.0217
Trypanosoma cruzi hexokinase, putative 0.1653 1 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0074 0.0405 0.0403
Schistosoma mansoni steroid hormone receptor ad4bp 0.0074 0.0405 0.0405
Brugia malayi nuclear receptor NHR-67 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0039 0.0193 0.0191
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.0132 1
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0012 0.0028 0.0026
Toxoplasma gondii hexokinase 0.1653 1 1
Schistosoma mansoni z-protein (S1r protein) 0.0011 0.0021 0.0021
Entamoeba histolytica hypothetical protein 0.0043 0.022 0.0217
Loa Loa (eye worm) hypothetical protein 0.0526 0.3149 0.3148
Echinococcus multilocularis segment polarity protein dishevelled 0.0011 0.0021 0.0019
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0039 0.0193 0.0191
Onchocerca volvulus 0.0074 0.0405 0.0403
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0074 0.0405 0.0403
Echinococcus granulosus ecdysone induced protein 78C 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Brugia malayi nuclear hormone receptor 0.0074 0.0405 0.0403
Loa Loa (eye worm) hexokinase 0.1653 1 1
Entamoeba histolytica hypothetical protein 0.0043 0.022 0.0217
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0074 0.0405 0.0403
Brugia malayi nuclear receptor RXR 0.0035 0.0168 0.0165
Echinococcus multilocularis hexokinase 0.1653 1 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0074 0.0405 0.0403
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0074 0.0405 0.0405
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0035 0.0168 0.0165
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0074 0.0405 0.0405
Brugia malayi Nuclear hormone receptor-like 1 0.0074 0.0405 0.0403
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0039 0.0193 0.0191
Loa Loa (eye worm) hexokinase 0.0512 0.3064 0.3062
Brugia malayi Steroid receptor seven-up type 2 0.0074 0.0405 0.0403
Brugia malayi Nuclear hormone receptor-like 1 0.0039 0.0193 0.0191
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0218 0.128 0.1278
Schistosoma mansoni nuclear receptor nhr-48 0.0035 0.0168 0.0168
Entamoeba histolytica hypothetical protein 0.0043 0.022 0.0217
Brugia malayi hexokinase type II 0.0526 0.3149 0.3148
Echinococcus granulosus segment polarity protein dishevelled 0.0011 0.0021 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0074 0.0405 0.0403
Trichomonas vaginalis DNA helicase recq, putative 0.0015 0.005 0.3673
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0028 0.0026
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0012 0.0028 0.0026
Giardia lamblia Sgs1 DNA helicase, putative 0.0012 0.0028 0.5
Echinococcus multilocularis hexokinase type 2 0.1653 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0039 0.0193 0.0191
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0008 0.0002 0.0002
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0012 0.0028 0.0026
Schistosoma mansoni dishevelled 0.0011 0.0021 0.0021
Schistosoma mansoni guanine-nucleotide-exchange-factor 0.0008 0.0002 0.0002
Echinococcus granulosus regulator of G protein signaling 7 0.0011 0.0021 0.0019
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.0074 0.0405 0.0403
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.137 0.828 0.828
Onchocerca volvulus 0.1653 1 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0035 0.0168 0.0165
Schistosoma mansoni DNA helicase recq1 0.0012 0.0028 0.0028
Loa Loa (eye worm) steroid hormone receptor 0.0074 0.0405 0.0403
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.022 0.0217
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0074 0.0405 0.0403
Loa Loa (eye worm) hexokinase type II 0.1653 1 1
Loa Loa (eye worm) hypothetical protein 0.0526 0.3149 0.3148
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0039 0.0193 0.0193
Schistosoma mansoni thyroid hormone receptor 0.0074 0.0405 0.0405
Echinococcus granulosus Pleckstrin G protein interacting region 0.0011 0.0021 0.0019
Entamoeba histolytica hexokinase 1 0.1653 1 1
Schistosoma mansoni ras GTP exchange factor 0.0008 0.0002 0.0002
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0008 0.0002 0.0002
Brugia malayi photoreceptor-specific nuclear receptor 0.0074 0.0405 0.0403
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0074 0.0405 0.0403
Trypanosoma brucei hexokinase 0.1653 1 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0074 0.0405 0.0403
Echinococcus multilocularis regulator of G protein signaling 7 0.0011 0.0021 0.0019
Schistosoma mansoni zinc finger protein 0.0035 0.0168 0.0168
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0074 0.0405 0.0403
Loa Loa (eye worm) hypothetical protein 0.0039 0.0193 0.0191
Schistosoma mansoni regulator of G protein signaling 0.0011 0.0021 0.0021
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0074 0.0405 0.0403
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0035 0.0168 0.0165
Schistosoma mansoni coup transcription factor 0.0074 0.0405 0.0405
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0035 0.0168 0.0165
Echinococcus multilocularis hexokinase 0.1653 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0074 0.0405 0.0405
Loa Loa (eye worm) hypothetical protein 0.0035 0.0168 0.0165
Loa Loa (eye worm) hypothetical protein 0.1128 0.6807 0.6806
Brugia malayi tailless protein 0.0035 0.0168 0.0165

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.7943 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) 10 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.3601 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (binding) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 29.0929 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) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) 32.6427 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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