Detailed information for compound 593748

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 363.764 | Formula: C18H13ClF3N3
  • H donors: 1 H acceptors: 0 LogP: 5.36 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccccc1C=NN=c1cc(C)[nH]c2c1cc(cc2)C(F)(F)F
  • InChi: 1S/C18H13ClF3N3/c1-11-8-17(25-23-10-12-4-2-3-5-15(12)19)14-9-13(18(20,21)22)6-7-16(14)24-11/h2-10H,1H3,(H,24,25)
  • InChiKey: XDTJXECGVDCQFC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Brugia malayi ecdysteroid receptor 0.0041 0.0353 0.0404
Echinococcus granulosus ecdysone induced protein 78C 0.0041 0.0353 0.0353
Entamoeba histolytica branched-chain amino acid aminotransferase, putative 0.0092 0.1302 1
Schistosoma mansoni hypothetical protein 0.0023 0.0034 0.0034
Echinococcus granulosus lysine specific demethylase 5A 0.0195 0.3197 0.3197
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0223 0.0255
Echinococcus multilocularis tumor protein p63 0.0329 0.5679 0.5679
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0041 0.0353 0.0353
Echinococcus multilocularis cysteine protease 0.0038 0.0299 0.0299
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0351 0.0351
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0041 0.0353 0.0353
Echinococcus granulosus JmjC domain containing protein 4 0.0051 0.0552 0.0552
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0041 0.0353 0.0353
Schistosoma mansoni phosphatidylserine receptor 0.0051 0.0552 0.0552
Schistosoma mansoni jumonji domain containing protein 0.0051 0.0552 0.0552
Leishmania major hypothetical protein, conserved 0.0051 0.0552 0.2451
Leishmania major hypothetical protein, conserved 0.0026 0.0092 0.0403
Leishmania major cathepsin L-like protease 0.0038 0.0299 0.1322
Brugia malayi Branched-chain amino acid aminotransferase, cytosolic, putative 0.0092 0.1302 0.149
Onchocerca volvulus Bile acid receptor homolog 0.0041 0.0353 0.1224
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0223 0.0223
Brugia malayi Bromodomain containing protein 0.0043 0.04 0.0458
Entamoeba histolytica cysteine proteinase, putative 0.0038 0.0299 0.186
Brugia malayi nuclear receptor NHR-88 0.0041 0.0353 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Echinococcus multilocularis cathepsin L cysteine protease 0.0038 0.0299 0.0299
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0041 0.0353 0.0353
Onchocerca volvulus 0.0151 0.2384 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0066 0.0819 0.0819
Loa Loa (eye worm) CYP4Cod1 0.0022 0.0002 0.0002
Onchocerca volvulus Cathepsin L homolog 0.0038 0.0299 0.0991
Schistosoma mansoni hypothetical protein 0.0033 0.0223 0.0223
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0041 0.0353 0.0353
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0038 0.0299 0.186
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Trypanosoma cruzi cysteine peptidase, putative 0.0143 0.2249 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Brugia malayi Cytochrome P450 family protein 0.0033 0.0213 0.0244
Mycobacterium ulcerans 4-amino-4-deoxychorismate lyase 0.0026 0.0092 0.0696
Loa Loa (eye worm) cysteine protease 0.0038 0.0299 0.0342
Loa Loa (eye worm) ctsf protein 0.0038 0.0299 0.0342
Brugia malayi hypothetical protein 0.0037 0.0294 0.0337
Mycobacterium ulcerans aldehyde dehydrogenase 0.0068 0.086 0.6599
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0051 0.0552 0.2451
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0041 0.0353 0.0404
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0041 0.0353 0.0404
Brugia malayi Muscleblind-like protein 0.0495 0.8739 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0041 0.0353 0.0404
Brugia malayi jmjC domain containing protein 0.0051 0.0552 0.0632
Brugia malayi Cathepsin L-like precursor 0.0025 0.0069 0.0079
Entamoeba histolytica hypothetical protein 0.0037 0.0294 0.1824
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.1557 0.1782
Trypanosoma brucei branched-chain amino acid aminotransferase, putative 0.0092 0.1302 0.5789
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0073 0.0073
Loa Loa (eye worm) jmjC domain-containing protein 0.0051 0.0552 0.0632
Brugia malayi photoreceptor-specific nuclear receptor 0.0295 0.5051 0.578
Loa Loa (eye worm) hypothetical protein 0.0495 0.8739 1
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0308 0.0308
Echinococcus granulosus cathepsin l1 0.0025 0.0069 0.0069
Toxoplasma gondii aldehyde dehydrogenase 0.0068 0.086 0.6345
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0819 0.3637
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0041 0.0353 0.0404
Echinococcus multilocularis lysine specific demethylase 6a 0.0051 0.0552 0.0552
Schistosoma mansoni hypothetical protein 0.0564 1 1
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0051 0.0552 0.2451
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0041 0.0353 0.0353
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0066 0.0819 0.3637
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0066 0.0819 0.6079
Schistosoma mansoni nuclear hormone receptor 0.0041 0.0353 0.0353
Plasmodium falciparum cysteine proteinase falcipain 3 0.0038 0.0299 0.4491
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0481 0.0481
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0041 0.0353 0.0404
Brugia malayi jmjC domain containing protein 0.0051 0.0552 0.0632
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0038 0.0299 0.186
Echinococcus multilocularis lysine specific demethylase 5A 0.0193 0.3158 0.3158
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0041 0.0353 0.0404
Echinococcus multilocularis geminin 0.0564 1 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0552 0.0632
Mycobacterium ulcerans aldehyde dehydrogenase 0.0068 0.086 0.6599
Brugia malayi jmjC domain containing protein 0.0193 0.3158 0.3613
Brugia malayi nuclear hormone receptor 0.0041 0.0353 0.0404
Echinococcus granulosus nuclear receptor co repressor related ncor 0.0297 0.5089 0.5089
Schistosoma mansoni RAR-like nuclear receptor 0.0041 0.0353 0.0353
Schistosoma mansoni steroid hormone receptor ad4bp 0.0041 0.0353 0.0353
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0041 0.0353 0.0353
Loa Loa (eye worm) hypothetical protein 0.0048 0.0494 0.0565
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0041 0.0353 0.0353
Echinococcus multilocularis ecdysone induced protein 78C 0.0041 0.0353 0.0353
Toxoplasma gondii Branched-chain-amino-acid aminotransferase 0.0092 0.1302 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0481 0.0481
Loa Loa (eye worm) hypothetical protein 0.0025 0.0069 0.0079
Loa Loa (eye worm) cytochrome P450 family protein 0.0033 0.0213 0.0244
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0092 0.1296 0.9947
Schistosoma mansoni zinc finger protein 0.0022 0.0012 0.0012
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0051 0.0552 0.0552
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus granulosus tumor protein p63 0.0329 0.5679 0.5679
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0494 0.0494
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0041 0.0353 0.0404
Plasmodium vivax vivapain-2 0.0038 0.0299 0.4491
Echinococcus multilocularis phd:f box containing protein 0.0051 0.0552 0.0552
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0294 0.0294
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0041 0.0353 0.0404
Brugia malayi Nuclear hormone receptor-like 1 0.0041 0.0353 0.0404
Onchocerca volvulus 0.0041 0.0353 0.1224
Loa Loa (eye worm) fibroinase 0.0038 0.0299 0.0342
Echinococcus multilocularis muscleblind protein 1 0.0495 0.8739 0.8739
Trypanosoma brucei branched-chain amino acid aminotransferase, putative 0.0092 0.1302 0.5789
Onchocerca volvulus Protein ultraspiracle homolog 0.0041 0.0353 0.1224
Brugia malayi Cathepsin L-like precursor 0.0025 0.0069 0.0079
Onchocerca volvulus Cathepsin F homolog 0.0038 0.0299 0.0991
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Onchocerca volvulus 0.0038 0.0299 0.0991
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0481 0.0481
Schistosoma mansoni coup transcription factor 0.0041 0.0353 0.0353
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0223 0.0255
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0131 0.2019 0.8979
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0193 0.3158 0.3158
Echinococcus granulosus lysine specific demethylase 6a 0.0051 0.0552 0.0552
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0054 0.0592 0.0592
Brugia malayi jmjC domain containing protein 0.0051 0.0552 0.0632
Leishmania major cathepsin L-like protease 0.0143 0.2249 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0068 0.086 0.6345
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0223 0.0255
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0067 0.0845 0.0845
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0041 0.0353 0.0404
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0041 0.0353 0.0353
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0041 0.0353 0.0404
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0038 0.0299 0.4491
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Leishmania major cathepsin L-like protease 0.0143 0.2249 1
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0051 0.0552 0.3802
Trypanosoma cruzi Aminotransferase class IV, putative 0.0026 0.0092 0.0403
Loa Loa (eye worm) hypothetical protein 0.0051 0.0552 0.0632
Echinococcus multilocularis jumonji domain containing 1A 0.0051 0.0552 0.0552
Schistosoma mansoni aldehyde dehydrogenase 0.0068 0.086 0.086
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0351 0.0351
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0073 0.0073
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0308 0.0308
Echinococcus multilocularis thyroid hormone receptor alpha 0.0182 0.2968 0.2968
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0142 0.222 0.222
Loa Loa (eye worm) jmjC domain-containing protein 0.0051 0.0552 0.0632
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus granulosus jumonji domain containing 1A 0.0051 0.0552 0.0552
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Mycobacterium ulcerans branched-chain amino acid aminotransferase 0.0092 0.1302 1
Schistosoma mansoni thyroid hormone receptor 0.0182 0.2968 0.2968
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0051 0.0552 0.2451
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0041 0.0353 0.0353
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0481 0.0551
Leishmania major cathepsin L-like protease 0.0038 0.0299 0.1322
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0041 0.0353 0.0353
Onchocerca volvulus 0.0048 0.0494 0.1834
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.094 0.1075
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0819 0.3637
Loa Loa (eye worm) jmjC domain-containing protein 0.0195 0.3197 0.3659
Schistosoma mansoni cathepsin F (C01 family) 0.0038 0.0299 0.0299
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0038 0.0299 0.0299
Schistosoma mansoni hypothetical protein 0.0033 0.0223 0.0223
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Loa Loa (eye worm) branched-chain amino acid aminotransferase 0.0092 0.1302 0.149
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Trypanosoma cruzi cruzipain precursor, putative 0.0143 0.2249 1
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0066 0.0819 0.0937
Mycobacterium leprae PROBABLE BRANCHED-CHAIN AMINO ACID TRANSAMINASE ILVE 0.0092 0.1302 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.094 0.1075
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Loa Loa (eye worm) hypothetical protein 0.008 0.1074 0.1229
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0041 0.0353 0.0404
Brugia malayi Bromodomain containing protein 0.0084 0.1163 0.133
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0041 0.0353 0.1224
Schistosoma mansoni jumonji/arid domain-containing protein 0.0195 0.3197 0.3197
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0073 0.0073
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0051 0.0552 0.3802
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0223 0.0223
Loa Loa (eye worm) hypothetical protein 0.0038 0.0299 0.0342
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Leishmania major cathepsin L-like protease 0.0143 0.2249 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0092 0.1296 0.9947
Echinococcus multilocularis JmjC domain containing protein 4 0.0051 0.0552 0.0552
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0041 0.0353 0.0404
Schistosoma mansoni hypothetical protein 0.0072 0.094 0.094
Schistosoma mansoni cathepsin F (C01 family) 0.0038 0.0299 0.0299
Plasmodium vivax JmjC domain containing protein 0.0051 0.0552 1
Leishmania major cathepsin L-like protease 0.0038 0.0299 0.1322
Loa Loa (eye worm) jmjC domain-containing protein 0.0051 0.0552 0.0632
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0034 0.0038
Echinococcus multilocularis nuclear receptor co repressor related (ncor) 0.0297 0.5089 0.5089
Schistosoma mansoni hypothetical protein 0.0142 0.222 0.222
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0038 0.0299 0.0299
Brugia malayi Cathepsin L-like cysteine proteinase 0.0025 0.0069 0.0079
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0038 0.0299 0.4491
Schistosoma mansoni hypothetical protein 0.0037 0.0294 0.0294
Schistosoma mansoni jumonji/arid domain-containing protein 0.0195 0.3197 0.3197
Schistosoma mansoni cathepsin F (C01 family) 0.0025 0.0069 0.0069
Echinococcus granulosus zinc finger protein 0.0022 0.0012 0.0012
Entamoeba histolytica cysteine protease, putative 0.0038 0.0299 0.186
Onchocerca volvulus Cathepsin L homolog 0.0038 0.0299 0.0991
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0481 0.0481
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0041 0.0353 0.0404
Loa Loa (eye worm) hypothetical protein 0.0051 0.0552 0.0632
Loa Loa (eye worm) hypothetical protein 0.0033 0.0223 0.0255
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0041 0.0353 0.0353
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0041 0.0353 0.0353
Schistosoma mansoni aldehyde dehydrogenase 0.0068 0.086 0.086
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0038 0.0299 0.0342
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0041 0.0353 0.0404
Echinococcus granulosus cathepsin l1 0.0038 0.0299 0.0299
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0294 0.0294
Loa Loa (eye worm) hypothetical protein 0.0025 0.0069 0.0079
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.1557 0.1782
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0481 0.0481
Loa Loa (eye worm) hypothetical protein 0.0025 0.0069 0.0079
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0038 0.0299 0.0342
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Schistosoma mansoni hypothetical protein 0.0564 1 1
Plasmodium falciparum JmjC domain-containing protein, putative 0.0051 0.0552 1
Onchocerca volvulus 0.0038 0.0299 0.0991
Entamoeba histolytica hypothetical protein 0.0037 0.0294 0.1824
Trypanosoma cruzi cysteine peptidase, putative 0.0038 0.0299 0.1322
Leishmania major cathepsin L-like protease 0.0038 0.0299 0.1322
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0041 0.0353 0.0404
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Schistosoma mansoni hypothetical protein 0.0033 0.0223 0.0223
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0066 0.0819 0.0819
Schistosoma mansoni jumonji domain containing protein 0.0193 0.3158 0.3158
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0068 0.086 0.382
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0481 0.0481
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Onchocerca volvulus 0.0038 0.0299 0.0991
Trichomonas vaginalis branched-chain amino acid aminotransferase, putative 0.0092 0.1302 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0041 0.0353 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Brugia malayi cathepsin L-like precursor 0.0025 0.0069 0.0079
Loa Loa (eye worm) hypothetical protein 0.0151 0.2384 0.2728
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0041 0.0353 0.0353
Schistosoma mansoni hypothetical protein 0.0033 0.0223 0.0223
Schistosoma mansoni phd/f-box containing protein 0.0051 0.0552 0.0552
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0451 0.0516
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0041 0.0353 0.0353
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0223 0.0223
Echinococcus granulosus FTZ F1 alpha 0.0041 0.0353 0.0353
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Loa Loa (eye worm) hypothetical protein 0.0106 0.1557 0.1782
Brugia malayi Papain family cysteine protease containing protein 0.0038 0.0299 0.0342
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0002 0.0002
Entamoeba histolytica hypothetical protein 0.0037 0.0294 0.1824
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0038 0.0299 0.0299
Onchocerca volvulus 0.0038 0.0299 0.0991
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.1557 0.1782
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0066 0.0819 0.0819
Echinococcus multilocularis FTZ F1 alpha 0.0041 0.0353 0.0353
Entamoeba histolytica cysteine proteinase, putative 0.0038 0.0299 0.186
Trypanosoma brucei branched-chain amino acid aminotransferase, putative 0.0092 0.1302 0.5789
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0041 0.0353 0.0404
Trypanosoma cruzi cysteine peptidase, putative 0.0143 0.2249 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0193 0.3158 0.3158
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0002 0.0002
Echinococcus granulosus GPCR family 2 0.0033 0.0223 0.0223
Leishmania major branched-chain amino acid aminotransferase, putative 0.0092 0.1302 0.5789
Echinococcus multilocularis zinc finger protein 0.0022 0.0012 0.0012
Schistosoma mansoni retinoic acid receptor RXR 0.0041 0.0353 0.0353
Brugia malayi steroid hormone receptor 0.0041 0.0353 0.0404
Loa Loa (eye worm) hypothetical protein 0.0495 0.8739 1
Brugia malayi PHD-finger family protein 0.0028 0.0122 0.014
Loa Loa (eye worm) hypothetical protein 0.0043 0.0402 0.046
Mycobacterium tuberculosis Branched-chain amino acid transaminase IlvE 0.0092 0.1302 1
Loa Loa (eye worm) hypothetical protein 0.0295 0.5051 0.578
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0294 0.0294
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0041 0.0353 0.0353
Plasmodium vivax vivapain-2 0.0038 0.0299 0.4491
Schistosoma mansoni protein phosphatase 2C 0.0051 0.0552 0.0552
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0142 0.222 0.222
Loa Loa (eye worm) hypothetical protein 0.0048 0.0491 0.0562
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0041 0.0353 0.0353
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0819 0.3637
Trichomonas vaginalis subgroup IIIi aminotransferase, putative 0.0092 0.1302 1
Leishmania major cathepsin L-like protease 0.0038 0.0299 0.1322
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0066 0.0819 0.0937
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0041 0.0353 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0068 0.086 0.086
Schistosoma mansoni thyroid hormone receptor 0.0182 0.2968 0.2968
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0041 0.0353 0.0353
Loa Loa (eye worm) hypothetical protein 0.0092 0.1296 0.1483
Schistosoma mansoni bromodomain containing protein 0.0071 0.0919 0.0919
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Toxoplasma gondii cathepsin CPL 0.0038 0.0299 0.1707
Brugia malayi jmjC domain containing protein 0.0051 0.0552 0.0632
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0041 0.0353 0.0353
Echinococcus granulosus phd:f box containing protein 0.0051 0.0552 0.0552
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Echinococcus multilocularis GPCR, family 2 0.0033 0.0223 0.0223
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0067 0.0845 0.0845
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0481 0.0481
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0038 0.0299 0.186
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0143 0.2249 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0353 0.0404
Brugia malayi Cytochrome P450 family protein 0.0022 0.0002 0.0002
Echinococcus multilocularis cysteine protease 0.0038 0.0299 0.0299
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Onchocerca volvulus 0.0038 0.0299 0.0991
Brugia malayi Cytochrome P450 family protein 0.0022 0.0002 0.0002
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0041 0.0353 0.0404
Brugia malayi Cathepsin L-like precursor 0.0038 0.0299 0.0342
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0481 0.0551
Echinococcus multilocularis cathepsin L cysteine protease 0.0038 0.0299 0.0299
Echinococcus multilocularis muscleblind protein 0.0495 0.8739 0.8739
Giardia lamblia Branched-chain amino acid aminotransferase lateral transfer candidate 0.0092 0.1302 1
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0054 0.0592 0.0592
Mycobacterium ulcerans aldehyde dehydrogenase 0.0068 0.086 0.6599
Echinococcus granulosus muscleblind protein 0.0495 0.8739 0.8739
Onchocerca volvulus 0.0038 0.0299 0.0991
Brugia malayi hypothetical protein 0.0151 0.2384 0.2728
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0223 0.0223
Brugia malayi Steroid receptor seven-up type 2 0.0041 0.0353 0.0404
Brugia malayi jmjC domain containing protein 0.0195 0.3197 0.3659
Trypanosoma cruzi cysteine peptidase, putative 0.0143 0.2249 1
Echinococcus granulosus cathepsin L cysteine proteinase 0.0038 0.0299 0.0299
Loa Loa (eye worm) steroid hormone receptor 0.0041 0.0353 0.0404
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0068 0.086 0.086
Trypanosoma brucei Aminotransferase class IV, putative 0.0026 0.0092 0.0403
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0041 0.0353 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0038 0.0299 0.186
Trypanosoma cruzi major cysteine proteinase, putative 0.0113 0.1683 0.7482
Leishmania major cysteine peptidase A (CPA) 0.0038 0.0299 0.1322
Entamoeba histolytica hypothetical protein 0.0037 0.0294 0.1824
Onchocerca volvulus 0.0038 0.0299 0.0991

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = -0.65 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = -0.33 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 0 % GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM. ChEMBL. 20485427
Inhibition (functional) = 0 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 1.27 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 75 % GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 100 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition frequency index (IFI) (functional) = 1.54 Inhibition Frequency Index (IFI) GSK. 20485427
Percent growth inhibition (functional) = -4 % Percent inhibition of HepG2 growth (at 10 uM) GSK. 20485427
Percent growth inhibition (functional) = -4 % Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 75 % Percent inhibition of P. falciparum Dd2 growth (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 100 % Percent inhibition of P. falciparum 3D7 growth (at 2 uM) GSK. 20485427
XC50 (functional) = 6.07 XC50 determination of P. falciparum 3D7 growth GSK. 20485427
XC50 (functional) = 0.85833 uM GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth. ChEMBL. 20485427

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.
 
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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.