Detailed information for compound 1301636

Basic information

Technical information
  • TDR Targets ID: 1301636
  • Name: 2,5-Dichloroaniline
  • MW: 162.017 | Formula: C6H5Cl2N
  • H donors: 1 H acceptors: 0 LogP: 2.5 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)N)Cl
  • InChi: 1S/C6H5Cl2N/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2
  • InChiKey: AVYGCQXNNJPXSS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2,5-dichlorophenyl)amine
  • 95-82-9
  • Fast Scarlet Base GGT
  • Fast Scarlet DS Base
  • Fast Scarlet GG Base
  • Fast Scarlet GGS Base
  • Fast Scarlet MDC Base
  • Fast scarlet 2g base
  • Fast scarlet 2g salt
  • Fast scarlet 2j salt
  • Fast scarlet GG salt
  • Fast scarlet ds salt
  • Fast scarlet ggs salt
  • Fast scarlet salt GG
  • Fast scarlet salt ggn
  • Hiltonil Fast Scarlet 2G Base
  • Hiltonil Fast Scarlet 2GS Base
  • Hiltosal fast scarlet 2g salt
  • Hindamine Scarlet GG
  • Hindasol fast scarlet GG salt
  • Kako scarlet GG salt
  • Kambamine Scarlet GG Base
  • Kayaku Scarlet GG Base
  • Lake Scarlet GG Base
  • Meisei scarlet GG salt
  • Mitsui Scarlet GG Base
  • Mitsui scarlet GG salt
  • NSC1492
  • Naphthanil Scarlet 2G Base
  • Naphtoelan Fast Scarlet GG Base
  • Naphtoelan fast scarlet GG salt
  • Natasol Scarlet GG Salt
  • Sanyo Fast Scarlet GG Base
  • Sanyo fast scarlet salt GG
  • Scarlet 2g base
  • Scarlet 2g salt
  • Scarlet Base Ciba I
  • Scarlet Base GG
  • Scarlet Base NGG
  • Scarlet Salt Ciba I
  • Scarlet base irga I (free base)
  • Scarlet salt irga I
  • Scarlet salt ngg
  • Spectrolene Scarlet 2G
  • Stabamine Scarlet GG
  • Symulon Scarlet 2G Base
  • Symulon scarlet 2g salt
  • WLN: ZR BG EG
  • 2-amino-1,4-dichlorobenzene
  • CHEBI:34245
  • ZINC00154585
  • 36702_RIEDEL
  • 2,5-DCA
  • 2,5-Dichloranilin [Czech]
  • 2,5-Dichloroaniline (NH2=1)
  • 2,5-Dichlorobenzenamine
  • 2,5-Dichlorobenzeneamine
  • 102024_ALDRICH
  • 4-12-00-01250 (Beilstein Handbook Reference)
  • AI3-01563
  • BRN 1447438
  • CCRIS 2881
  • CI 37010
  • CI Azoic Diazo Component 3
  • EINECS 202-455-2
  • HSDB 5295
  • NSC 1492
  • 2,5-DICHLORO-ANILINE
  • InChI=1/C6H5Cl2N/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H
  • ST5213716
  • 35190_FLUKA
  • C14712
  • NCGC00091852-01
  • 1-Amino-2,5-dichlorobenzene
  • 2,5-Dichloranilin
  • 2,5-Dichloro-1-aminobenzene
  • 2,5-Dichloroaniline [NH2=1]
  • Amarthol Fast Scarlet GG Base
  • Amarthol Fast Scarlet GGS Base
  • Amarthol fast scarlet GG salt
  • Aniline, 2,5-dichloro-
  • Azobase DCA
  • Azoene Fast Scarlet 2G Base
  • Azoene fast scarlet 2g salt
  • Azofix scarlet GG salt
  • Azogene Fast Scarlet GGC
  • Azogene fast scarlet GG (free base)
  • Azoic diazo component 3
  • Benzenamine, 2,5-dichloro-
  • C.I. 37010
  • C.I. Azoic Diazo Component 3
  • Daito Scarlet Base GG
  • Daito scarlet salt GG
  • Devol Scarlet 2GS Base
  • Devol scarlet 2GS salt
  • Devol scarlet A (free base)
  • Devol scarlet salt A
  • Diazo Fast Scarlet GG
  • Diazol Scarlet 2Zh
  • Durgasol scarlet GG salt
  • Fast Red SGG Base
  • Fast Scarlet 2G
  • Fast Scarlet Base 2J
  • Fast Scarlet Base 2JS

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens tumor protein p53 Starlite/ChEMBL No references
Homo sapiens thyroid stimulating hormone receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Brugia malayi follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Echinococcus granulosus tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Loa Loa (eye worm) follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
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
Echinococcus multilocularis mothers against decapentaplegic 2 0.0068 0.013 0.0382
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0084 0.0204 0.0601
Brugia malayi steroid hormone receptor 0.0075 0.0161 0.0161
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0075 0.0161 0.0474
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0152 0.0513 0.1511
Loa Loa (eye worm) transcription factor SMAD2 0.2233 1 1
Schistosoma mansoni Smad4 0.0152 0.0513 0.0807
Schistosoma mansoni smad1 5 8 and 0.0152 0.0513 0.0807
Echinococcus multilocularis tar DNA binding protein 0.0785 0.3398 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0058 0.0171
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0075 0.0161 0.0161
Schistosoma mansoni tar DNA-binding protein 0.0785 0.3398 0.534
Echinococcus granulosus FTZ F1 alpha 0.0075 0.0161 0.0474
Echinococcus granulosus tyrosine protein kinase ABL1 0.0683 0.2932 0.8629
Loa Loa (eye worm) glycosyl transferase family 8 protein 0.0076 0.0166 0.0166
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0075 0.0161 0.0161
Echinococcus granulosus ecdysone induced protein 78C 0.0075 0.0161 0.0474
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0075 0.0161 0.0253
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0444 0.1844 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0152 0.0513 0.0513
Echinococcus granulosus tar DNA binding protein 0.0785 0.3398 1
Brugia malayi latrophilin 2 splice variant baaae 0.1436 0.6363 0.6363
Echinococcus multilocularis isocitrate dehydrogenase (NAD+) 0.0054 0.0066 0.0193
Schistosoma mansoni hypothetical protein 0.0175 0.0616 0.0968
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0444 0.1844 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 0.084
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 0.5
Echinococcus granulosus mothers against decapentaplegic 5 0.0152 0.0513 0.1511
Brugia malayi nuclear hormone receptor 0.0075 0.0161 0.0161
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0119 0.0364 0.171
Loa Loa (eye worm) hypothetical protein 0.21 0.9392 0.9392
Brugia malayi MH1 domain containing protein 0.0152 0.0513 0.0513
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0075 0.0161 0.0161
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0152 0.0513 0.0807
Echinococcus multilocularis GPCR, family 2 0.0664 0.2848 0.8382
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Brugia malayi nuclear receptor NHR-88 0.0075 0.0161 0.0161
Echinococcus multilocularis isocitrate dehydrogenase (NAD) subunit 0.0054 0.0066 0.0193
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0075 0.0161 0.0474
Brugia malayi Probable isocitrate dehydrogenase 0.0054 0.0066 0.0066
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0075 0.0161 0.0161
Echinococcus granulosus Glycosyltransferase protein LARGE1 0.0056 0.0077 0.0226
Schistosoma mansoni Smad4 0.0068 0.013 0.0204
Loa Loa (eye worm) hypothetical protein 0.0188 0.0677 0.0677
Echinococcus granulosus mothers against decapentaplegic 2 0.0068 0.013 0.0382
Loa Loa (eye worm) hypothetical protein 0.0517 0.2174 0.2174
Brugia malayi Thioredoxin reductase 0.0052 0.0058 0.0058
Brugia malayi Calcitonin receptor-like protein seb-1 0.21 0.9392 0.9392
Loa Loa (eye worm) steroid hormone receptor 0.0075 0.0161 0.0161
Mycobacterium tuberculosis Probable oxidoreductase 0.0133 0.0424 0.205
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0075 0.0161 0.0161
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0075 0.0161 0.0161
Schistosoma mansoni tar DNA-binding protein 0.0785 0.3398 0.534
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0075 0.0161 0.0161
Entamoeba histolytica tartrate dehydrogenase, putative 0.0054 0.0066 1
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0074 0.0155 0.0457
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0075 0.0161 0.0161
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0075 0.0161 0.0161
Echinococcus granulosus tumor protein p63 0.0408 0.168 0.4943
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0785 0.3398 0.3398
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0133 0.0424 0.205
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0075 0.0161 0.0161
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0085 0.0208 0.3976
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Echinococcus granulosus TGF beta signal transducer SmadC 0.0152 0.0513 0.1511
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0133 0.0424 1
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0444 0.1844 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0075 0.0161 0.0161
Schistosoma mansoni glycosyltransferase-related 0.0076 0.0166 0.0261
Echinococcus multilocularis peptidase Clp (S14 family) 0.0056 0.0074 0.0219
Loa Loa (eye worm) isocitrate dehydrogenase gamma subunit 0.0054 0.0066 0.0066
Trichomonas vaginalis isocitrate dehydrogenase, putative 0.0054 0.0066 1
Schistosoma mansoni tyrosine kinase 0.0673 0.2888 0.4538
Onchocerca volvulus 0.0075 0.0161 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0119 0.0364 0.171
Brugia malayi follicle stimulating hormone receptor 0.0282 0.1106 0.1106
Schistosoma mansoni hypothetical protein 0.0664 0.2848 0.4476
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0444 0.1844 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0664 0.2848 0.8382
Brugia malayi ecdysteroid receptor 0.0075 0.0161 0.0161
Mycobacterium tuberculosis Probable reductase 0.0119 0.0364 0.171
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Schistosoma mansoni hypothetical protein 0.0084 0.0204 0.0321
Schistosoma mansoni unc-13 (munc13) 0.0054 0.0066 0.0103
Loa Loa (eye worm) TAR-binding protein 0.0785 0.3398 0.3398
Brugia malayi MH2 domain containing protein 0.0152 0.0513 0.0513
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 1
Toxoplasma gondii LsmAD domain-containing protein 0.0188 0.0677 0.3666
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0075 0.0161 0.0161
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0056 0.0074 0.0244
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0075 0.0161 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0552 0.2335 0.6873
Schistosoma mansoni smad1 5 8 and 0.0152 0.0513 0.0807
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0075 0.0161 0.0161
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0075 0.0161 0.0474
Echinococcus granulosus Smad4 0.0152 0.0513 0.1511
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0085 0.0208 0.0613
Brugia malayi MH1 domain containing protein 0.0152 0.0513 0.0513
Echinococcus multilocularis geminin 0.0175 0.0616 0.1812
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0074 0.0155 0.0457
Echinococcus granulosus glycosyltransferase protein LARGE2 0.0074 0.0155 0.0457
Brugia malayi isocitrate dehydrogenase [NAD] subunit alpha, mitochondrial 0.0054 0.0066 0.0066
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0058 0.0171
Brugia malayi isocitrate dehydrogenase [NAD] subunit beta, mitochondrial 0.0054 0.0066 0.0066
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.0002 0.0005
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0075 0.0161 0.0161
Brugia malayi MH1 domain containing protein 0.0084 0.0203 0.0203
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0683 0.2932 0.8629
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0444 0.1844 0.2898
Loa Loa (eye worm) hypothetical protein 0.057 0.2417 0.2417
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0119 0.0364 0.8308
Plasmodium falciparum ataxin-2 like protein, putative 0.0188 0.0677 0.3466
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0444 0.1844 1
Echinococcus multilocularis Smad4 0.0152 0.0513 0.1511
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0085 0.0208 0.1121
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0444 0.1844 0.5427
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0075 0.0161 0.0161
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0075 0.0161 0.0474
Brugia malayi Tyrosine-protein kinase abl-1 0.0414 0.1707 0.1707
Loa Loa (eye worm) inositol-1 0.004 0.0002 0.0002
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 0.5
Schistosoma mansoni hypothetical protein 0.0664 0.2848 0.4476
Schistosoma mansoni tar DNA-binding protein 0.0785 0.3398 0.534
Brugia malayi Glycosyl transferase family 8 protein 0.0076 0.0166 0.0166
Schistosoma mansoni RAR-like nuclear receptor 0.0075 0.0161 0.0253
Echinococcus granulosus Glycosyl transferase family 8 0.0076 0.0166 0.0489
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0444 0.1844 1
Schistosoma mansoni hypothetical protein 0.0664 0.2848 0.4476
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0085 0.0208 0.1121
Loa Loa (eye worm) pigment dispersing factor receptor c 0.21 0.9392 0.9392
Echinococcus multilocularis tyrosine protein kinase Abl 0.0278 0.1089 0.3204
Echinococcus multilocularis ecdysone induced protein 78C 0.0075 0.0161 0.0474
Schistosoma mansoni thyroid hormone receptor 0.0075 0.0161 0.0253
Onchocerca volvulus Protein ultraspiracle homolog 0.0075 0.0161 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0075 0.0161 0.0253
Brugia malayi mothers against decapentaplegic homolog 3 0.0068 0.013 0.013
Brugia malayi Smad1 0.0152 0.0513 0.0513
Brugia malayi RNA recognition motif domain containing protein 0.0785 0.3398 0.3398
Loa Loa (eye worm) hypothetical protein 0.006 0.0092 0.0092
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0075 0.0161 0.0474
Schistosoma mansoni nuclear hormone receptor 0.0075 0.0161 0.0253
Leishmania major isocitrate dehydrogenase, putative 0.0054 0.0066 0.0347
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0444 0.1844 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0075 0.0161 0.0253
Brugia malayi hypothetical protein 0.0188 0.0677 0.0677
Loa Loa (eye worm) nuclear factor I 0.0084 0.0203 0.0203
Leishmania major trypanothione reductase 0.0052 0.0058 0.0306
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0075 0.0161 0.0161
Brugia malayi MH2 domain containing protein 0.0152 0.0513 0.0513
Brugia malayi photoreceptor-specific nuclear receptor 0.057 0.2417 0.2417
Echinococcus multilocularis Glycosyl transferase, family 8 0.0076 0.0166 0.0489
Schistosoma mansoni coup transcription factor 0.0075 0.0161 0.0253
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0664 0.2848 0.8382
Brugia malayi Isocitrate dehydrogenase 0.0444 0.1844 0.1844
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0075 0.0161 0.0474
Onchocerca volvulus Bile acid receptor homolog 0.0075 0.0161 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0068 0.013 0.013
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0084 0.0204 0.0601
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0056 0.0074 0.0091
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0075 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.0085 0.0208 0.0208
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0075 0.0161 0.0161
Brugia malayi TAR-binding protein 0.0785 0.3398 0.3398
Brugia malayi Inositol-1 0.004 0.0002 0.0002
Echinococcus granulosus GPCR family 2 0.0664 0.2848 0.8382
Echinococcus multilocularis thyroid hormone receptor alpha 0.0075 0.0161 0.0474
Echinococcus granulosus geminin 0.0175 0.0616 0.1812
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0075 0.0161 0.0253
Echinococcus granulosus mothers against decapentaplegic 6 0.0068 0.013 0.0382
Brugia malayi Probable ClpP-like protease 0.0085 0.0208 0.0208
Onchocerca volvulus Mothers against decapentaplegic homolog 0.0068 0.013 0.5486
Toxoplasma gondii isocitrate dehydrogenase 0.0444 0.1844 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0119 0.0364 0.171
Schistosoma mansoni Smad4 0.0068 0.013 0.0204
Schistosoma mansoni Isocitrate dehydrogenase [NAD] subunit gamma mitochondrial 0.0054 0.0066 0.0103
Brugia malayi glutathione reductase 0.0052 0.0058 0.0058
Loa Loa (eye worm) MH2 domain-containing protein 0.2233 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0075 0.0161 0.0253
Schistosoma mansoni smad 0.0068 0.013 0.0204
Brugia malayi Latrophilin receptor protein 2 0.0664 0.2848 0.2848
Brugia malayi isocitrate dehydrogenase 0.0444 0.1844 0.1844
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0085 0.0208 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Trypanosoma brucei PAB1-binding protein , putative 0.0188 0.0677 0.3666
Schistosoma mansoni tar DNA-binding protein 0.0785 0.3398 0.534
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0444 0.1844 0.5427
Mycobacterium tuberculosis Probable dehydrogenase 0.0119 0.0364 0.171
Echinococcus multilocularis mothers against decapentaplegic 6 0.0068 0.013 0.0382
Brugia malayi hypothetical protein 0.0121 0.0373 0.0373
Echinococcus granulosus peptidase Clp S14 family 0.0056 0.0074 0.0219
Loa Loa (eye worm) MH2 domain-containing protein 0.0068 0.013 0.013
Echinococcus granulosus isocitrate dehydrogenase NAD 0.0054 0.0066 0.0193
Mycobacterium tuberculosis Probable 3-isopropylmalate dehydrogenase LeuB (beta-IPM dehydrogenase) (IMDH) (3-IPM-DH) 0.0054 0.0066 0.0042
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0058 0.0058
Schistosoma mansoni hypothetical protein 0.0664 0.2848 0.4476
Echinococcus granulosus smad 0.0152 0.0513 0.1511
Echinococcus multilocularis tumor protein p63 0.0408 0.168 0.4943
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0444 0.1844 0.5427
Loa Loa (eye worm) nuclear hormone receptor 0.0512 0.2155 0.2155
Loa Loa (eye worm) glutathione reductase 0.0052 0.0058 0.0058
Leishmania major hypothetical protein, conserved 0.0188 0.0677 0.3666
Plasmodium falciparum ataxin-2 like protein, putative 0.0188 0.0677 0.3466
Trypanosoma cruzi PAB1-binding protein , putative 0.0188 0.0677 0.3666
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0075 0.0161 0.0253
Schistosoma mansoni tar DNA-binding protein 0.0785 0.3398 0.534
Schistosoma mansoni peptidase Clp (S14 family) 0.0085 0.0208 0.0327
Schistosoma mansoni thyroid hormone receptor 0.0075 0.0161 0.0253
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0444 0.1844 1
Loa Loa (eye worm) Smad1 0.0152 0.0513 0.0513
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0664 0.2848 0.8382
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0075 0.0161 0.0474
Loa Loa (eye worm) hypothetical protein 0.1436 0.6363 0.6363
Schistosoma mansoni hypothetical protein 0.0175 0.0616 0.0968
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0056 0.0074 0.0091
Loa Loa (eye worm) RNA binding protein 0.0785 0.3398 0.3398
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0664 0.2848 0.8382
Schistosoma mansoni cellular tumor antigen P53 0.006 0.0092 0.0145
Schistosoma mansoni inositol monophosphatase 0.004 0.0002 0.0003
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0075 0.0161 0.0161
Trypanosoma cruzi PAB1-binding protein , putative 0.0188 0.0677 0.3666
Toxoplasma gondii thioredoxin reductase 0.0052 0.0058 0.0306
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0075 0.0161 0.0161
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0444 0.1844 0.5427
Wolbachia endosymbiont of Brugia malayi isocitrate dehydrogenase 0.0054 0.0066 0.3095
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0119 0.0364 0.171
Loa Loa (eye worm) latrophilin receptor protein 2 0.0664 0.2848 0.2848
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0075 0.0161 0.0474
Schistosoma mansoni smad1 5 8 and 0.0152 0.0513 0.0807
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0085 0.0208 0.084
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0552 0.2335 0.6873
Loa Loa (eye worm) hypothetical protein 0.0054 0.0066 0.0066
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0058 0.0306
Echinococcus multilocularis Glycosyltransferase protein LARGE1 0.0056 0.0077 0.0226
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0075 0.0161 0.0474
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.21 0.9392 0.9392
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0075 0.0161 0.0474
Brugia malayi MH1 domain containing protein 0.0084 0.0203 0.0203
Echinococcus granulosus isocitrate dehydrogenase NAD subunit 0.0054 0.0066 0.0193
Mycobacterium ulcerans 3-isopropylmalate dehydrogenase 0.0054 0.0066 0.3095
Brugia malayi RNA binding protein 0.0785 0.3398 0.3398
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0133 0.0424 0.205
Brugia malayi Probable isocitrate dehydrogenase 0.0054 0.0066 0.0066
Loa Loa (eye worm) isocitrate dehydrogenase 0.0444 0.1844 0.1844
Loa Loa (eye worm) hypothetical protein 0.0084 0.0203 0.0203
Trypanosoma brucei trypanothione reductase 0.0052 0.0058 0.0306
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0074 0.0155 0.0457
Echinococcus multilocularis smad 0.0152 0.0513 0.1511
Schistosoma mansoni isocitrate dehydrogenase 0.0054 0.0066 0.0103
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0075 0.0161 0.0253
Echinococcus granulosus inositol monophosphatase 1 0.004 0.0002 0.0005
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Loa Loa (eye worm) MH1 domain-containing protein 0.0152 0.0513 0.0513
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0444 0.1844 0.5427
Brugia malayi MH2 domain containing protein 0.0068 0.013 0.013
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0085 0.0208 0.0613
Schistosoma mansoni smad 0.0152 0.0513 0.0807
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0664 0.2848 0.2848
Echinococcus multilocularis FTZ F1 alpha 0.0075 0.0161 0.0474
Echinococcus multilocularis isocitrate dehydrogenase 0.0444 0.1844 0.5427
Brugia malayi Isocitrate dehydrogenase subunit gamma, mitochondrial precursor 0.0054 0.0066 0.0066
Plasmodium vivax ataxin-2 like protein, putative 0.0188 0.0677 0.3466
Schistosoma mansoni inositol monophosphatase 0.004 0.0002 0.0003
Brugia malayi Steroid receptor seven-up type 2 0.0552 0.2335 0.2335
Echinococcus multilocularis conserved hypothetical protein 0.0056 0.0077 0.0226
Echinococcus multilocularis mothers against decapentaplegic 5 0.0152 0.0513 0.1511
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.0068 0.013 0.013
Toxoplasma gondii isocitrate dehydrogenase 0.0444 0.1844 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0282 0.1106 0.1106
Brugia malayi Nuclear hormone receptor-like 1 0.0075 0.0161 0.0161
Brugia malayi Tyrosine-protein kinase abl-1 0.0278 0.1089 0.1089
Loa Loa (eye worm) hypothetical protein 0.0075 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.0664 0.2848 0.2848
Loa Loa (eye worm) TK/ABL protein kinase 0.0683 0.2932 0.2932
Loa Loa (eye worm) hypothetical protein 0.0259 0.1001 0.1001
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0075 0.0161 0.0253
Schistosoma mansoni hypothetical protein 0.1436 0.6363 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0075 0.0161 0.0474

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.01 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Permissive Temperature. (Class of assay: confirmatory) [Related pubchem assays: 902 ] ChEMBL. No reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 5.0119 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) 66.8242 uM PubChem BioAssay. qHTS assay for small molecule agonists of the antioxidant response element (ARE) signaling pathway. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 66.8242 uM PubChem BioAssay. qHTS assay to identify small molecules that stimulate interleukin-8 (IL-8) secretion. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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