Detailed information for compound 280830

Basic information

Technical information
  • TDR Targets ID: 280830
  • Name: 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-7-[ 4-(2-methoxyphenyl)piperazin-1-yl]-4-oxoquino line-3-carboxylic acid
  • MW: 487.471 | Formula: C25H24F3N3O4
  • H donors: 1 H acceptors: 3 LogP: 4.94 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1N1CCN(CC1)c1c(F)cc2c(c1C(F)F)n(cc(c2=O)C(=O)O)C1CC1
  • InChi: 1S/C25H24F3N3O4/c1-35-19-5-3-2-4-18(19)29-8-10-30(11-9-29)22-17(26)12-15-21(20(22)24(27)28)31(14-6-7-14)13-16(23(15)32)25(33)34/h2-5,12-14,24H,6-11H2,1H3,(H,33,34)
  • InChiKey: PDPGVJWJIVLLHZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-7-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-7-[4-(2-methoxyphenyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-4-keto-7-[4-(2-methoxyphenyl)piperazino]quinoline-3-carboxylic acid
  • 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-4-keto-7-[4-(2-methoxyphenyl)piperazin-1-yl]quinoline-3-carboxylic acid
  • 3-Quinolinecarboxylic acid, 1-cyclopropyl-8-(difluoromethyl)-6-fluoro-1,4-dihydro-7-[4-(2-methoxyphenyl)-1-piperazinyl]-4-oxo-
  • AIDS-023807
  • AIDS023807

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
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0014 0.0038 0.0007
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Schistosoma mansoni neuropeptide receptor 0.0014 0.0038 0.0007
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0079
Echinococcus granulosus dnaJ subfamily B 0.0383 0.3404 0.6101
Schistosoma mansoni amine GPCR 0.0014 0.0038 0.0007
Trypanosoma cruzi folylpolyglutamate synthase, putative 0.0097 0.0797 0.2291
Echinococcus multilocularis GPCR, family 2 0.0015 0.0044 0.0011
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Schistosoma mansoni hypothetical protein 0.0014 0.0038 0.0007
Loa Loa (eye worm) hypothetical protein 0.004 0.0272 0.0417
Brugia malayi CXXC zinc finger family protein 0.0027 0.0155 0.0155
Loa Loa (eye worm) hypothetical protein 0.0037 0.0243 0.0365
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.0168 0.1439 0.3241
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0108 0.0126
Echinococcus multilocularis GA binding protein alpha chain 0.0065 0.0502 0.084
Schistosoma mansoni neuropeptide receptor 0.0014 0.0038 0.0007
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Echinococcus granulosus GA binding protein alpha chain 0.0065 0.0502 0.084
Brugia malayi sulfakinin receptor protein 0.0014 0.0038 0.0038
Brugia malayi dihydrofolate reductase family protein 0.0168 0.1439 0.1439
Schistosoma mansoni myosin xvIII 0.0014 0.0038 0.0007
Schistosoma mansoni methyl-cpg binding protein mbd 0.0015 0.0049 0.0026
Entamoeba histolytica hypothetical protein 0.0032 0.0204 0.5
Schistosoma mansoni biogenic amine (5HT) receptor 0.016 0.1371 0.2421
Schistosoma mansoni neuropeptide F-like receptor 0.0014 0.0038 0.0007
Brugia malayi Tachykinin-like peptides receptor 99D 0.0014 0.0038 0.0038
Echinococcus multilocularis muscleblind protein 0.014 0.1186 0.208
Schistosoma mansoni neuropeptide receptor 0.0014 0.0038 0.0007
Echinococcus granulosus folylpolyglutamate synthase, mitochondrial 0.0097 0.0797 0.1375
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0108 0.0126
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Leishmania major folylpolyglutamate synthetase 0.0097 0.0797 0.2291
Schistosoma mansoni neuropeptide f receptor 76f 0.0014 0.0038 0.0007
Schistosoma mansoni hypothetical protein 0.0052 0.0383 0.0631
Loa Loa (eye worm) thymidylate synthase 0.0314 0.2778 0.4889
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0044 0.001
Chlamydia trachomatis dihydrofolate reductase 0.0168 0.1439 0.5
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0016 0.0054 0.0036
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0032 0.0203 0.0299
Schistosoma mansoni hypothetical protein 0.0341 0.3021 0.5409
Brugia malayi larval opioid receptor 0.0014 0.0038 0.0038
Schistosoma mansoni amine GPCR 0.0014 0.0038 0.0007
Brugia malayi hypothetical protein 0.015 0.1274 0.1274
Brugia malayi Bromodomain containing protein 0.0069 0.0537 0.0537
Loa Loa (eye worm) dihydrofolate reductase 0.0168 0.1439 0.25
Schistosoma mansoni cpg binding protein 0.003 0.0184 0.0271
Schistosoma mansoni hypothetical protein 0.0383 0.3404 0.6104
Schistosoma mansoni aldehyde dehydrogenase 0.0111 0.0925 0.1613
Brugia malayi latrophilin 2 splice variant baaae 0.0032 0.0201 0.0201
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0014 0.0038 0.0007
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0044 0.0011
Brugia malayi hypothetical protein 0.0254 0.2231 0.2231
Loa Loa (eye worm) hypothetical protein 0.0254 0.2231 0.3912
Loa Loa (eye worm) hypothetical protein 0.0132 0.1112 0.1916
Onchocerca volvulus 0.0052 0.0383 0.1258
Schistosoma mansoni biogenic amine receptor 0.0014 0.0038 0.0007
Schistosoma mansoni neuropeptide F-like receptor 0.0014 0.0038 0.0007
Onchocerca volvulus 0.0314 0.2778 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0044 0.0011
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0044 0.0011
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Brugia malayi neuropeptide F receptor 0.0014 0.0038 0.0038
Brugia malayi Serotonin receptor 0.0014 0.0038 0.0038
Schistosoma mansoni growth hormone secretagogue receptor 0.0014 0.0038 0.0007
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0379 0.3363 1
Onchocerca volvulus Putative folylpolyglutamate synthase 0.0097 0.0797 0.2769
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0111 0.0925 0.1607
Schistosoma mansoni methyl-cpg binding protein mbd 0.0015 0.0049 0.0026
Schistosoma mansoni microtubule-associated protein tau 0.0619 0.5555 1
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0314 0.2778 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0032 0.0203 0.0299
Mycobacterium ulcerans aldehyde dehydrogenase 0.0111 0.0925 0.0646
Brugia malayi Fli-1 protein 0.0197 0.1708 0.1708
Brugia malayi G protein-coupled receptor 0.0014 0.0038 0.0038
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0111 0.0925 0.1607
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Echinococcus granulosus dihydrofolate reductase 0.0168 0.1439 0.2539
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0111 0.0925 0.2675
Schistosoma mansoni hypothetical protein 0.0014 0.0038 0.0007
Echinococcus multilocularis muscleblind protein 1 0.014 0.1186 0.208
Loa Loa (eye worm) bromodomain containing protein 0.0016 0.0054 0.0028
Schistosoma mansoni dihydrofolate reductase 0.0168 0.1439 0.2544
Echinococcus granulosus histone lysine methyltransferase setb 0.0016 0.0054 0.0029
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0379 0.3363 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0014 0.0038 0.0038
Echinococcus granulosus cpg binding protein 0.003 0.0184 0.0265
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0055 0.0412 0.0677
Schistosoma mansoni hypothetical protein 0.0015 0.0044 0.0017
Echinococcus multilocularis serotonin receptor 0.016 0.1371 0.2415
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0014 0.0038 0.0007
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0014 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0015 0.0044 0.0017
Mycobacterium ulcerans aldehyde dehydrogenase 0.0111 0.0925 0.0646
Loa Loa (eye worm) hypothetical protein 0.016 0.1371 0.2378
Echinococcus granulosus survival motor neuron protein 1 0.0254 0.2231 0.3974
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0052 0.0383 0.0383
Brugia malayi hypothetical protein 0.0032 0.0204 0.0204
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0044 0.0044
Echinococcus multilocularis folylpolyglutamate synthase, mitochondrial 0.0097 0.0797 0.1375
Mycobacterium ulcerans aldehyde dehydrogenase 0.0111 0.0925 0.0646
Brugia malayi Ets-domain containing protein 0.0065 0.0502 0.0502
Onchocerca volvulus 0.0027 0.0155 0.0425
Loa Loa (eye worm) hypothetical protein 0.0032 0.0201 0.0289
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0014 0.0038 0.0007
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.0168 0.1439 0.3241
Echinococcus multilocularis serotonin receptor 0.016 0.1371 0.2415
Trypanosoma cruzi folylpolyglutamate synthetase 0.0097 0.0797 0.2291
Onchocerca volvulus Huntingtin homolog 0.0132 0.1112 0.3919
Trichomonas vaginalis conserved hypothetical protein 0.015 0.1274 1
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0056 0.0416 0.0674
Schistosoma mansoni opsin-like receptor 0.0014 0.0038 0.0007
Echinococcus multilocularis thymidylate synthase 0.0314 0.2778 0.4966
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0055 0.0412 0.0677
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Loa Loa (eye worm) PHD-finger family protein 0.0019 0.0078 0.0071
Brugia malayi ORL1-like opioid receptor 0.0014 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0016 0.0054 0.0028
Brugia malayi Bromodomain containing protein 0.0034 0.0223 0.0223
Mycobacterium tuberculosis Hypothetical protein 0.015 0.1274 0.2409
Schistosoma mansoni biogenic amine receptor 0.0014 0.0038 0.0007
Schistosoma mansoni hypothetical protein 0.0341 0.3021 0.5409
Loa Loa (eye worm) hypothetical protein 0.0628 0.5642 1
Brugia malayi Dopamine receptor protein 1 0.0014 0.0038 0.0038
Schistosoma mansoni bromodomain containing protein 0.0058 0.0441 0.0736
Schistosoma mansoni transcription factor LCR-F1 0.0032 0.0204 0.0306
Schistosoma mansoni biogenic amine receptor 0.0014 0.0038 0.0007
Entamoeba histolytica hypothetical protein 0.0032 0.0204 0.5
Echinococcus granulosus microtubule associated protein 2 0.0619 0.5555 1
Loa Loa (eye worm) hypothetical protein 0.014 0.1186 0.2047
Schistosoma mansoni gabp alpha 0.0065 0.0502 0.0846
Brugia malayi G-protein coupled receptor 0.0014 0.0038 0.0038
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0032 0.0204 0.03
Schistosoma mansoni amine GPCR 0.0014 0.0038 0.0007
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0108 0.0133
Schistosoma mansoni histamine h1 receptor 0.0014 0.0038 0.0007
Schistosoma mansoni cpg binding protein 0.003 0.0184 0.0271
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0044 0.0044
Brugia malayi hypothetical protein 0.0132 0.1112 0.1112
Trypanosoma brucei folylpolyglutamate synthase, putative 0.0097 0.0797 0.2291
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.0168 0.1439 0.3241
Brugia malayi FolC bifunctional protein 0.0097 0.0797 0.0797
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0379 0.3363 1
Echinococcus granulosus geminin 0.0341 0.3021 0.5406
Brugia malayi Calcitonin receptor-like protein seb-1 0.0047 0.0335 0.0335
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0314 0.2778 0.497
Brugia malayi G-protein coupled receptor 0.0014 0.0038 0.0038
Echinococcus multilocularis cpg binding protein 0.003 0.0184 0.0265
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Echinococcus granulosus muscleblind protein 0.014 0.1186 0.208
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Schistosoma mansoni zinc finger protein 0.0019 0.0084 0.0089
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0014 0.0038 0.0007
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0014 0.0038 0.0038
Schistosoma mansoni opsin-like receptor 0.0014 0.0038 0.0007
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0016 0.0054 0.0036
Brugia malayi putative neuropeptide receptor 0.0014 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0014 0.0038 0.0007
Loa Loa (eye worm) hypothetical protein 0.014 0.1186 0.2047
Brugia malayi thymidylate synthase 0.0314 0.2778 0.2778
Echinococcus multilocularis survival motor neuron protein 1 0.0254 0.2231 0.3974
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0016 0.0054 0.0029
Echinococcus multilocularis dihydrofolate reductase 0.0168 0.1439 0.2539
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Brugia malayi RE15519p 0.0014 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0047 0.0335 0.053
Brugia malayi neuropeptide F receptor 0.0014 0.0038 0.0038
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0379 0.3363 1
Toxoplasma gondii bifunctional protein FolC subfamily protein 0.0097 0.0797 0.1358
Echinococcus granulosus zinc finger protein 0.0019 0.0084 0.0082
Mycobacterium ulcerans thymidylate synthase 0.0314 0.2778 1
Brugia malayi GnHR receptor homolog 0.0014 0.0038 0.0038
Echinococcus multilocularis microtubule associated protein 2 0.0619 0.5555 1
Onchocerca volvulus Huntingtin homolog 0.0132 0.1112 0.3919
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0047 0.0335 0.0335
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0065 0.0502 0.0827
Schistosoma mansoni neuropeptide receptor 0.0014 0.0038 0.0007
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0057 0.043 0.0716
Brugia malayi Dopamine receptor protein 2 0.0014 0.0038 0.0038
Echinococcus granulosus GPCR family 2 0.0015 0.0044 0.0011
Schistosoma mansoni alpha-1 adrenergic receptor 0.0014 0.0038 0.0007
Echinococcus granulosus thymidylate synthase 0.0314 0.2778 0.4966
Brugia malayi follicle stimulating hormone receptor 0.0014 0.0038 0.0038
Schistosoma mansoni cpg binding protein 0.0027 0.0155 0.0218
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Schistosoma mansoni survival motor neuron protein 0.0052 0.0383 0.0631
Echinococcus multilocularis zinc finger protein 0.0019 0.0084 0.0082
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0014 0.0038 0.0007
Schistosoma mansoni hypothetical protein 0.0014 0.0038 0.0007
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0014 0.0038 0.0038
Echinococcus granulosus methyl CpG binding domain protein 2 0.0015 0.0049 0.0019
Loa Loa (eye worm) CXXC zinc finger family protein 0.0027 0.0155 0.0208
Echinococcus granulosus folylpolyglutamate synthase mitochondrial 0.0097 0.0797 0.1375
Brugia malayi Muscleblind-like protein 0.014 0.1186 0.1186
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0015 0.0049 0.0019
Brugia malayi Melatonin receptor type 1A 0.0014 0.0038 0.0038
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0314 0.2778 1
Entamoeba histolytica hypothetical protein 0.0032 0.0204 0.5
Loa Loa (eye worm) FolC protein 0.0097 0.0797 0.1354
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0047 0.0335 0.053
Schistosoma mansoni folylpolyglutamate synthase 0.0097 0.0797 0.1381
Schistosoma mansoni hypothetical protein 0.0032 0.0201 0.0301
Brugia malayi putative neuropeptide receptor NPR1 0.0014 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0015 0.0044 0.0017
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0111 0.0925 0.0646
Echinococcus granulosus biogenic amine 5HT receptor 0.016 0.1371 0.2415
Brugia malayi Ets-domain containing protein 0.0065 0.0502 0.0502
Loa Loa (eye worm) hypothetical protein 0.0034 0.0223 0.033
Toxoplasma gondii aldehyde dehydrogenase 0.0111 0.0925 0.1789
Schistosoma mansoni ets-related 0.0197 0.1708 0.3031
Echinococcus multilocularis geminin 0.0341 0.3021 0.5406
Schistosoma mansoni amine GPCR 0.0014 0.0038 0.0007
Schistosoma mansoni aldehyde dehydrogenase 0.0111 0.0925 0.1613
Brugia malayi G protein-coupled receptor F59B2.13 0.0014 0.0038 0.0038
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0014 0.0038 0.0007
Schistosoma mansoni opsin-like receptor 0.0014 0.0038 0.0007
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0014 0.0038 0.0007
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0379 0.3363 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0014 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0032 0.0204 0.0306
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0014 0.0038 0.0007
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0014 0.0038 0.0007
Echinococcus multilocularis dnaJ subfamily B 0.0383 0.3404 0.6101
Brugia malayi Dopamine receptor 0.0014 0.0038 0.0038
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0014 0.0038 0.0007
Schistosoma mansoni amine GPCR 0.0014 0.0038 0.0007
Entamoeba histolytica hypothetical protein 0.0032 0.0204 0.5
Loa Loa (eye worm) hypothetical protein 0.016 0.1371 0.2378
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0032 0.0204 0.03
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0379 0.3363 1
Schistosoma mansoni adenoreceptor 0.0014 0.0038 0.0007
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.015 0.1274 0.3724
Echinococcus multilocularis folylpolyglutamate synthase, mitochondrial 0.0097 0.0797 0.1375
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0014 0.0038 0.0007
Brugia malayi PHD-finger family protein 0.0024 0.0127 0.0127
Treponema pallidum folylpolyglutamate synthetase (folC) 0.0097 0.0797 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0044 0.0011
Brugia malayi Dihydrofolate reductase 0.0168 0.1439 0.1439
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0014 0.0038 0.0007
Loa Loa (eye worm) hypothetical protein 0.0132 0.1112 0.1916
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0015 0.0044 0.001
Schistosoma mansoni biogenic amine (5HT) receptor 0.0014 0.0038 0.0007
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0014 0.0038 0.0007
Brugia malayi hypothetical protein 0.0014 0.0038 0.0038
Brugia malayi AKH receptor 0.0014 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0015 0.0044 0.0017
Loa Loa (eye worm) fli-1 protein 0.0197 0.1708 0.298
Loa Loa (eye worm) hypothetical protein 0.0063 0.0488 0.0802

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) = 12 uM The compound was tested for cytotoxicity against mock-infected MT-4 cells. ChEMBL. 11858992
CC50 (functional) = 12 uM The compound was tested for cytotoxicity against mock-infected MT-4 cells. ChEMBL. 11858992
IC50 (functional) = 0.56 uM The compound was tested against HIV-1(IIIB) replication on the inhibition of virus -induced cytopathogenicity in MT-4 cells. ChEMBL. 11858992
IC50 (functional) = 0.56 uM The compound was tested against HIV-1(IIIB) replication on the inhibition of virus -induced cytopathogenicity in MT-4 cells. ChEMBL. 11858992

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 11858992

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.

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