Detailed information for compound 1029417

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 371.429 | Formula: C19H18FN3O2S
  • H donors: 1 H acceptors: 0 LogP: 2.84 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc2c(cc1OC)CC1C2=NN(C1c1ccc(cc1)F)C(=S)N
  • InChi: 1S/C19H18FN3O2S/c1-24-15-8-11-7-14-17(13(11)9-16(15)25-2)22-23(19(21)26)18(14)10-3-5-12(20)6-4-10/h3-6,8-9,14,18H,7H2,1-2H3,(H2,21,26)
  • InChiKey: QPOVAXRQPIMWFQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Loa Loa (eye worm) hypothetical protein 0.0064 0.1398 0.2219
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0691 0.1585
Onchocerca volvulus 0.0029 0.0515 0.2215
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Schistosoma mansoni hypothetical protein 0.0356 0.8631 0.8631
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0286 0.0286
Entamoeba histolytica hypothetical protein 0.004 0.0794 1
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.001 0.0057 0.0057
Schistosoma mansoni DNA ligase IV 0.0011 0.0072 0.0072
Loa Loa (eye worm) hypothetical protein 0.0013 0.0132 0.0209
Schistosoma mansoni lipoxygenase 0.0055 0.1162 0.1162
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Brugia malayi latrophilin 2 splice variant baaae 0.0139 0.3253 0.5163
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0072 0.0035
Onchocerca volvulus 0.0011 0.0072 0.0068
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.0011 0.0072 0.0191
Echinococcus multilocularis tar DNA binding protein 0.0262 0.6301 0.6301
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0132 0.0185
Schistosoma mansoni chromosome transmission fidelity factor 0.0011 0.0072 0.0072
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.0691 0.0691
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0691 0.8605
Echinococcus granulosus GPCR family 2 0.0064 0.1398 0.1398
Echinococcus granulosus Polycystic kidney disease protein 0.002 0.0286 0.0286
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0064 0.1398 0.1398
Schistosoma mansoni lipoxygenase 0.002 0.0286 0.0286
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0263 0.2354
Echinococcus multilocularis RUN 0.002 0.0286 0.0286
Echinococcus granulosus RUN 0.002 0.0286 0.0286
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0203 0.4852 0.77
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.0091
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.001 0.0057 0.0057
Echinococcus multilocularis Polycystic kidney disease protein 0.002 0.0286 0.0286
Echinococcus granulosus guanine nucleotide binding protein G protein 0.001 0.0057 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0072 0.0035
Schistosoma mansoni alpha-glucosidase 0.0139 0.326 0.326
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0013 0.0132 0.1005
Schistosoma mansoni loxhd1 0.002 0.0286 0.0286
Loa Loa (eye worm) RNA binding protein 0.0262 0.6301 1
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0176 0.4177 0.6629
Echinococcus multilocularis geminin 0.0356 0.8631 0.8631
Echinococcus granulosus tar DNA binding protein 0.0262 0.6301 0.6301
Brugia malayi Glycosyl hydrolases family 31 protein 0.0162 0.382 0.6063
Echinococcus granulosus guanine nucleotide binding protein subunit 0.001 0.0057 0.0057
Leishmania major alpha glucosidase II subunit, putative 0.0036 0.0691 1
Mycobacterium leprae PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+]) 0.0011 0.0072 0.5
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0011 0.0072 0.0035
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0263 1
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0013 0.0132 0.0968
Brugia malayi Calcitonin receptor-like protein seb-1 0.0203 0.4852 0.77
Plasmodium falciparum LCCL domain-containing protein 0.002 0.0286 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.0691 0.1097
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.0691 0.5716
Schistosoma mansoni topbp1 0.0011 0.0072 0.0072
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0072 0.0035
Schistosoma mansoni tar DNA-binding protein 0.0262 0.6301 0.6301
Schistosoma mansoni ap endonuclease 0.0019 0.0263 0.0263
Schistosoma mansoni hypothetical protein 0.0064 0.1398 0.1398
Brugia malayi hypothetical protein 0.0011 0.0072 0.0114
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.001 0.0057 0.0057
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0064 0.1398 0.1398
Toxoplasma gondii exonuclease III APE 0.0019 0.0263 0.1769
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0011 0.0072 0.0035
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0691 0.1585
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0021 0.0021
Schistosoma mansoni hypothetical protein 0.0356 0.8631 0.8631
Schistosoma mansoni GTP-binding protein (I) alpha subunit gnai 0.001 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.004 0.0794 0.0794
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0011 0.0072 0.0035
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0242 0.5811 0.9223
Brugia malayi Glycosyl hydrolases family 31 protein 0.0013 0.0132 0.0209
Brugia malayi guanine nucleotide-binding protein G(o), alpha subunit, putative 0.001 0.0057 0.0091
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0242 0.5811 0.5811
Schistosoma mansoni tar DNA-binding protein 0.0262 0.6301 0.6301
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0242 0.5811 0.9223
Entamoeba histolytica hypothetical protein 0.004 0.0794 1
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0072 0.0035
Brugia malayi Guanine nucleotide-binding protein alpha-6 subunit, putative 0.001 0.0057 0.0091
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0132 0.0185
Brugia malayi CXXC zinc finger family protein 0.0029 0.0515 0.0818
Echinococcus multilocularis dnaJ subfamily B 0.0411 1 1
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.0011 0.0072 0.0114
Brugia malayi hypothetical protein 0.002 0.0286 0.0454
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0021 0.0021
Onchocerca volvulus 0.002 0.0286 0.1105
Brugia malayi GTP-binding regulatory protein alpha chain - starfish, putative 0.001 0.0057 0.0091
Schistosoma mansoni GTP-binding protein alpha subunit 0.001 0.0057 0.0057
Echinococcus granulosus lysosomal alpha glucosidase 0.0162 0.382 0.382
Schistosoma mansoni tar DNA-binding protein 0.0262 0.6301 0.6301
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-12 subunit 0.001 0.0057 0.0091
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0263 0.3095
Brugia malayi Doublecortin family protein 0.002 0.0286 0.0454
Echinococcus multilocularis replication factor c subunit 1 0.0011 0.0072 0.0072
Brugia malayi G-protein alpha subunit 0.001 0.0057 0.0091
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.2746 0.4357
Schistosoma mansoni polycystin 1-related 0.002 0.0286 0.0286
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-6 subunit 0.001 0.0057 0.0091
Schistosoma mansoni rab6-interacting 0.002 0.0286 0.0286
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0263 0.0515
Echinococcus granulosus expressed protein 0.001 0.0057 0.0057
Brugia malayi guanine nucleotide-binding protein alpha-7 subunit, putative 0.001 0.0057 0.0091
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.382 0.382
Echinococcus granulosus nibrin 0.0011 0.0072 0.0072
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0263 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0132 0.0185
Loa Loa (eye worm) hypothetical protein 0.0203 0.4852 0.77
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0286 0.0286
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0286 0.0286
Loa Loa (eye worm) heterotrimeric G protein alpha subunit 0.001 0.0057 0.0091
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0242 0.5811 0.5811
Trichomonas vaginalis replication factor C large subunit, putative 0.0011 0.0072 0.0035
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0263 0.0515
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0263 0.3095
Brugia malayi Guanine nucleotide-binding protein alpha-12 subunit, putative 0.001 0.0057 0.0091
Schistosoma mansoni ap endonuclease 0.0019 0.0263 0.0263
Entamoeba histolytica hypothetical protein 0.004 0.0794 1
Brugia malayi Latrophilin receptor protein 2 0.0064 0.1398 0.2219
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.1318 0.1318
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.001 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.0091
Plasmodium vivax multidomain scavenger receptor, putative 0.002 0.0286 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0263 0.0263
Brugia malayi hypothetical protein 0.002 0.0286 0.0454
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0072 0.0035
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0011 0.0072 0.0035
Loa Loa (eye worm) hypothetical protein 0.002 0.0286 0.0454
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Loa Loa (eye worm) hypothetical protein 0.0176 0.4177 0.6629
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0691 0.1585
Schistosoma mansoni transcription factor LCR-F1 0.004 0.0794 0.0794
Echinococcus multilocularis expressed protein 0.001 0.0057 0.0057
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0242 0.5811 0.5811
Echinococcus granulosus replication factor c subunit 1 0.0011 0.0072 0.0072
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.001 0.0057 0.0091
Brugia malayi hypothetical protein 0.0011 0.0072 0.0114
Echinococcus granulosus cpg binding protein 0.003 0.0556 0.0556
Schistosoma mansoni trimeric G-protein alpha o subunit 0.001 0.0057 0.0057
Entamoeba histolytica hypothetical protein 0.004 0.0794 1
Echinococcus multilocularis GPCR, family 2 0.0064 0.1398 0.1398
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.382 0.382
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0262 0.6301 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.0794 0.0794
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Schistosoma mansoni cpg binding protein 0.0029 0.0515 0.0515
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.0091
Schistosoma mansoni hypothetical protein 0.002 0.0286 0.0286
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0691 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0242 0.5811 0.5811
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0013 0.0132 0.0185
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0263 0.8952
Schistosoma mansoni tar DNA-binding protein 0.0262 0.6301 0.6301
Chlamydia trachomatis DNA ligase 0.0011 0.0072 0.5
Echinococcus granulosus gtp binding protein I alpha 1subunit 0.001 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0064 0.1398 0.1398
Brugia malayi guanine nucleotide-binding protein alpha-3 subunit, putative 0.001 0.0057 0.0091
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0132 0.0185
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.001 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.002 0.0286 0.0454
Brugia malayi MH2 domain containing protein 0.0119 0.2746 0.4357
Echinococcus granulosus guanine nucleotide binding protein subunit 0.001 0.0057 0.0057
Trypanosoma brucei glycosyl hydrolase-like protein 0.0013 0.0132 0.0968
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0242 0.5811 0.5811
Loa Loa (eye worm) GTP-binding regulatory protein alpha chain 0.001 0.0057 0.0091
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0242 0.5811 0.5811
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.001 0.0057 0.0057
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0013 0.0132 0.0358
Brugia malayi RNA binding protein 0.0262 0.6301 1
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.001 0.0057 0.0057
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.0691 0.0691
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0691 0.1585
Brugia malayi hypothetical protein 0.001 0.0057 0.0091
Schistosoma mansoni GTP-binding protein alpha subunit 0.001 0.0057 0.0057
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0263 0.3095
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0055 0.1162 0.1162
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0263 1
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.2746 0.4357
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0263 1
Echinococcus multilocularis nibrin 0.0011 0.0072 0.0072
Echinococcus multilocularis cpg binding protein 0.003 0.0556 0.0556
Schistosoma mansoni tar DNA-binding protein 0.0262 0.6301 0.6301
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.001 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0411 1 1
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.001 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0064 0.1398 0.1398
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0013 0.0132 0.0185
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0263 0.0263
Trichomonas vaginalis maltase-glucoamylase, putative 0.0036 0.0691 0.1585
Onchocerca volvulus 0.0094 0.2125 1
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.001 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0064 0.1398 0.1398
Loa Loa (eye worm) TAR-binding protein 0.0262 0.6301 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0242 0.5811 0.5811
Schistosoma mansoni cpg binding protein 0.003 0.0556 0.0556
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0691 0.1585
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0263 0.2795
Brugia malayi DKFZp564C0469 protein 0.0011 0.0072 0.0114
Loa Loa (eye worm) latrophilin receptor protein 2 0.0064 0.1398 0.2219
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0064 0.1398 0.2219
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0018 0.0029
Schistosoma mansoni topbp1 0.0011 0.0072 0.0072
Trypanosoma brucei glucosidase, putative 0.0036 0.0691 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0263 0.0418
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0162 0.382 0.6063
Brugia malayi guanine nucleotide-binding protein G-o protein alpha subunit 0.001 0.0057 0.0091
Onchocerca volvulus 0.002 0.0286 0.1105
Echinococcus multilocularis gtp binding protein (I) alpha 1subunit 0.001 0.0057 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0171 0.4057 1
Schistosoma mansoni alpha glucosidase 0.0036 0.0691 0.0691
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0021 0.0033
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0013 0.0132 0.0968
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0286 0.0286
Brugia malayi Pax transcription activation domain interacting protein 0.0011 0.0072 0.0114
Trichomonas vaginalis sucrase-isomaltase, putative 0.0036 0.0691 0.1585
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0064 0.1398 0.1398
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0515 0.0818
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.001 0.0057 0.0057
Brugia malayi topoisomerase 0.0011 0.0072 0.0114
Loa Loa (eye worm) doublecortin family protein 0.002 0.0286 0.0454
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.001 0.0057 0.0091
Schistosoma mansoni cpg binding protein 0.003 0.0556 0.0556
Brugia malayi hypothetical protein 0.004 0.0794 0.1261
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0263 0.5
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0263 0.0418
Loa Loa (eye worm) hypothetical protein 0.0011 0.0072 0.0114
Entamoeba histolytica hypothetical protein 0.0011 0.0072 0.0191
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0263 0.8952
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0203 0.4852 0.77
Schistosoma mansoni rab6-interacting 0.002 0.0286 0.0286
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0132 0.0185
Trichomonas vaginalis maltase-glucoamylase, putative 0.0013 0.0132 0.0185
Brugia malayi RNA recognition motif domain containing protein 0.0262 0.6301 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.0691 0.1097
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0064 0.1398 0.1398
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.001 0.0057 0.0057
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0691 0.1585
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.0091
Echinococcus granulosus geminin 0.0356 0.8631 0.8631
Schistosoma mansoni alpha-glucosidase 0.0139 0.326 0.326
Brugia malayi TAR-binding protein 0.0262 0.6301 1
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.001 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.0091
Schistosoma mansoni hypothetical protein 0.0139 0.3253 0.3253
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.1156 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.0794 0.0794
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0691 0.1585
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0691 1
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0055 0.1162 0.1162
Loa Loa (eye worm) hypothetical protein 0.0139 0.3253 0.5163
Loa Loa (eye worm) G protein alpha subunit 3 0.001 0.0057 0.0091
Echinococcus granulosus guanine nucleotide binding protein G protein 0.001 0.0057 0.0057
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0691 0.8605

Activities

Activity type Activity value Assay description Source Reference
CC50 (ADMET) = 39.89 uM Cytotoxicity against mock-infected human MT4 cells assessed as decrease in cell viability by MTT assay ChEMBL. 23099090
MBC (functional) = 8 ug ml-1 Antimicrobial activity against Escherichia coli NCIM 5051 by broth dilution technique ChEMBL. 23099090
MFC (functional) > 512 ug ml-1 Antimicrobial activity against Candida albicans NCIM 3471 by broth dilution technique ChEMBL. 23099090
MIC (functional) = 6.25 uM Antimycobacterial activity against isoniazid-resistant Mycobacterium tuberculosis after 2 weeks by BACTEC 460 radiometric method ChEMBL. 21807509

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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