Detailed information for compound 1065588

Basic information

Technical information
  • TDR Targets ID: 1065588
  • Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4- [(2-cyanoacetyl)amino]benzoate
  • MW: 346.338 | Formula: C16H18N4O5
  • H donors: 3 H acceptors: 5 LogP: 1.7 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CCC(=O)Nc1ccc(cc1)C(=O)OCC(=O)NC(=O)NC(C)C
  • InChi: 1S/C16H18N4O5/c1-10(2)18-16(24)20-14(22)9-25-15(23)11-3-5-12(6-4-11)19-13(21)7-8-17/h3-6,10H,7,9H2,1-2H3,(H,19,21)(H2,18,20,22,24)
  • InChiKey: QMXRIJMCIJSQAH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-[(2-cyanoacetyl)amino]benzoate
  • 4-[(2-cyano-1-oxoethyl)amino]benzoic acid [2-[[(isopropylamino)-oxomethyl]amino]-2-oxoethyl] ester
  • 4-[(2-cyanoacetyl)amino]benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester
  • [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-(2-cyanoethanoylamino)benzoate
  • ZINC03371161
  • T0519-5808
  • MLS000571148
  • SMR000150803

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
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0132 0.0097
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0128 0.1352 0.3357
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Loa Loa (eye worm) hypothetical protein 0.0244 0.2715 0.6859
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0112 0.1154 0.2851
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.0323 0.0816
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0203 0.0168
Loa Loa (eye worm) hypothetical protein 0.0257 0.2863 0.7235
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Schistosoma mansoni aldehyde dehydrogenase 0.0128 0.1352 0.3376
Plasmodium falciparum glycylpeptide N-tetradecanoyltransferase 0.035 0.3958 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0289 0.0254
Brugia malayi hypothetical protein 0.0112 0.1154 0.2915
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0203 0.0512
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0203 0.2228 0.5603
Brugia malayi hypothetical protein 0.0257 0.2863 0.7235
Echinococcus granulosus histone lysine methyltransferase setb 0.0048 0.0407 0.0949
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0245 0.272 1
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Onchocerca volvulus 0.0031 0.02 0.0048
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0049 0.0418 0.0863
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.0418 0.0384
Echinococcus granulosus glycylpeptide N tetradecanoyltransferase 0.035 0.3958 1
Schistosoma mansoni hypothetical protein 0.0021 0.0088 0.0165
Echinococcus granulosus methyl CpG binding domain protein 2 0.0018 0.0045 0.0025
Onchocerca volvulus 0.0038 0.0289 0.038
Brugia malayi beta-lactamase family protein 0.0038 0.0289 0.0729
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0048 0.0407 0.0975
Onchocerca volvulus 0.005 0.0424 0.0887
Mycobacterium ulcerans aldehyde dehydrogenase 0.0128 0.1352 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0203 0.0026
Mycobacterium ulcerans aldehyde dehydrogenase 0.0128 0.1352 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0128 0.1352 0.3376
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0128 0.1352 0.1322
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0088 0.0224
Trichomonas vaginalis CAMK family protein kinase 0.01 0.1021 0.1995
Schistosoma mansoni transcription factor LCR-F1 0.0112 0.1154 0.2872
Brugia malayi CXXC zinc finger family protein 0.003 0.0187 0.0472
Echinococcus granulosus zinc finger protein 0.0022 0.0096 0.0154
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0424 0.1072
Brugia malayi mbt repeat family protein 0.0049 0.0418 0.1056
Schistosoma mansoni hypothetical protein 0.0017 0.0035 0.0029
Brugia malayi PHD-finger family protein 0.0027 0.016 0.0405
Schistosoma mansoni caspase-7 (C14 family) 0.0033 0.0225 0.0511
Echinococcus granulosus tar DNA binding protein 0.0067 0.0631 0.152
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.0462 0.1168
Entamoeba histolytica serine/threonine protein kinase, putative 0.0203 0.2228 0.3831
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0187 0.0472
Echinococcus multilocularis histone acetyltransferase MYST2 0.0056 0.0498 0.0465
Schistosoma mansoni hypothetical protein 0.0026 0.0143 0.0305
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0289 0.0674
Brugia malayi Pre-SET motif family protein 0.021 0.2318 0.5857
Schistosoma mansoni myelin transcription factor 1 myt1 0.0056 0.0498 0.1206
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0938 0.2323
Brugia malayi serine/threonine-protein kinase plk-2 0.0203 0.2228 0.5629
Brugia malayi RNA binding protein 0.0067 0.0631 0.1595
Loa Loa (eye worm) hypothetical protein 0.0036 0.0264 0.0668
Brugia malayi Bromodomain containing protein 0.0033 0.0232 0.0585
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0102 0.1034 0.1003
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0203 0.2228 0.2201
Giardia lamblia Kinase, PLK 0.0203 0.2228 0.5393
Trypanosoma cruzi N-myristoyl transferase, putative 0.035 0.3958 1
Schistosoma mansoni jumonji domain containing protein 0.0081 0.0788 0.1943
Schistosoma mansoni hypothetical protein 0.0036 0.0264 0.0612
Schistosoma mansoni aldehyde dehydrogenase 0.0128 0.1352 0.3376
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0132 0.0246
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0631 0.1545
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0128 0.1352 0.4373
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0938 0.0906
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0289 0.0674
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.021 0.2318 0.5857
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0203 0.2228 0.559
Echinococcus granulosus survival motor neuron protein 1 0.0244 0.2715 0.6831
Loa Loa (eye worm) hypothetical protein 0.0073 0.0698 0.1763
Plasmodium vivax glycylpeptide N-tetradecanoyltransferase, putative 0.035 0.3958 1
Schistosoma mansoni serine/threonine protein kinase 0.0203 0.2228 0.5603
Brugia malayi N-myristoyltransferase 2 0.035 0.3958 1
Giardia lamblia CDC72 0.035 0.3958 1
Toxoplasma gondii aldehyde dehydrogenase 0.0128 0.1352 1
Schistosoma mansoni N-myristoyltransferase 0.035 0.3958 1
Onchocerca volvulus Alhambra homolog 0.0031 0.0203 0.006
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0289 0.0674
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0203 0.0008
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.0462 0.1168
Brugia malayi Bromodomain containing protein 0.004 0.0303 0.0767
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0418 0.1002
Loa Loa (eye worm) hypothetical protein 0.0053 0.0462 0.1168
Trypanosoma cruzi N-myristoyl transferase, putative 0.035 0.3958 1
Schistosoma mansoni hypothetical protein 0.0017 0.0035 0.0029
Brugia malayi TAR-binding protein 0.0067 0.0631 0.1595
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.0035 0.0089
Loa Loa (eye worm) hypothetical protein 0.0031 0.0203 0.0512
Schistosoma mansoni hypothetical protein 0.0299 0.3366 0.8495
Brugia malayi beta-lactamase family protein 0.0038 0.0289 0.0729
Onchocerca volvulus 0.0038 0.0289 0.038
Echinococcus multilocularis lysine specific demethylase 5A 0.0038 0.028 0.0245
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0203 0.0456
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0194 0.2125 0.2097
Brugia malayi hypothetical protein 0.0244 0.2715 0.6859
Schistosoma mansoni cpg binding protein 0.0033 0.023 0.0525
Schistosoma mansoni bromodomain containing protein 0.0067 0.0627 0.1535
Loa Loa (eye worm) hypothetical protein 0.0017 0.0035 0.0089
Brugia malayi F/Y-rich N-terminus family protein 0.0022 0.01 0.0252
Echinococcus granulosus caspase 2 0.0033 0.0225 0.0483
Onchocerca volvulus 0.0033 0.0225 0.0141
Brugia malayi PHD-finger family protein 0.0031 0.0203 0.0512
Schistosoma mansoni cpg binding protein 0.0033 0.023 0.0525
Schistosoma mansoni survival motor neuron protein 0.005 0.0424 0.1019
Mycobacterium leprae Probable lipase LipE 0.0038 0.0289 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.0462 0.1168
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0275 0.024
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.02 0.0165
Onchocerca volvulus Huntingtin homolog 0.0257 0.2863 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0289 0.0729
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0631 0.1545
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.0418 0.0976
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0203 0.2228 0.5629
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0938 0.23
Echinococcus multilocularis apoptotic protease activating factor 1 0.0033 0.0225 0.019
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0418 0.1002
Onchocerca volvulus 0.0239 0.266 0.9239
Trichomonas vaginalis N-myristoyl transferase, putative 0.035 0.3958 1
Echinococcus multilocularis zinc finger protein 0.0022 0.0096 0.0061
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Loa Loa (eye worm) hypothetical protein 0.0257 0.2863 0.7235
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0018 0.0045 0.001
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0056 0.0498 0.0465
Echinococcus multilocularis peregrin 0.0033 0.0232 0.0197
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0275 0.0611
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0592 0.1495
Trypanosoma brucei N-myristoyl transferase, putative 0.035 0.3958 1
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.0418 0.0384
Loa Loa (eye worm) hypothetical protein 0.004 0.0304 0.0769
Loa Loa (eye worm) hypothetical protein 0.0053 0.0464 0.1172
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0045 0.0054
Echinococcus granulosus lysine specific demethylase 5A 0.0041 0.0323 0.0733
Trypanosoma brucei polo-like protein kinase 0.0203 0.2228 0.5603
Loa Loa (eye worm) hypothetical protein 0.0056 0.0498 0.1259
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0048 0.0407 0.0975
Schistosoma mansoni hypothetical protein 0.005 0.0424 0.1019
Brugia malayi Pre-SET motif family protein 0.0031 0.02 0.0505
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.0938 0.2369
Schistosoma mansoni hypothetical protein 0.0171 0.1851 0.4645
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Trichomonas vaginalis set domain proteins, putative 0.0239 0.266 0.6462
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0938 0.0906
Loa Loa (eye worm) hypothetical protein 0.0042 0.0333 0.0842
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0056 0.0498 0.118
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0938 0.2323
Echinococcus granulosus cpg binding protein 0.0033 0.023 0.0497
Schistosoma mansoni zinc finger protein 0.0022 0.0096 0.0183
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0289 0.0674
Brugia malayi mbt repeat family protein 0.0049 0.0418 0.1056
Loa Loa (eye worm) N-myristoyltransferase 2 0.035 0.3958 1
Leishmania major hypothetical protein, conserved 0.0038 0.0289 0.0674
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0067 0.0631 0.1595
Echinococcus granulosus histone acetyltransferase MYST2 0.0056 0.0498 0.118
Trypanosoma cruzi polo-like protein kinase, putative 0.0203 0.2228 0.5603
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.02 0.0448
Echinococcus multilocularis survival motor neuron protein 1 0.0244 0.2715 0.2689
Loa Loa (eye worm) RNA binding protein 0.0067 0.0631 0.1595
Leishmania major N-myristoyl transferase, putative 0.035 0.3958 1
Loa Loa (eye worm) TAR-binding protein 0.0067 0.0631 0.1595
Onchocerca volvulus 0.0049 0.0418 0.0863
Schistosoma mansoni hypothetical protein 0.0033 0.0225 0.0511
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.0938 0.2369
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0289 0.0674
Echinococcus multilocularis tar DNA binding protein 0.0067 0.0631 0.0598
Echinococcus multilocularis glycylpeptide N tetradecanoyltransferase 0.035 0.3958 0.3937
Brugia malayi Bromodomain containing protein 0.0079 0.077 0.1945
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0035 0.0089
Mycobacterium ulcerans aldehyde dehydrogenase 0.0128 0.1352 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0376 0.0951
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0056 0.0498 0.1259
Echinococcus granulosus peregrin 0.0033 0.0232 0.0501
Loa Loa (eye worm) hypothetical protein 0.0033 0.0225 0.0568
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0289 0.0646
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0052 0.0132
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0035 0.0089
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0102 0.1034 0.2547
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0323 0.0761
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0289 0.0729
Onchocerca volvulus Cell death protein 3 homolog 0.0033 0.0225 0.0141
Brugia malayi beta-lactamase 0.0038 0.0289 0.0729
Schistosoma mansoni hypothetical protein 0.0171 0.1851 0.4645
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0631 0.1545
Toxoplasma gondii ABC1 family protein 0.0038 0.0289 0.0771
Loa Loa (eye worm) hypothetical protein 0.0038 0.0289 0.0729
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Schistosoma mansoni hypothetical protein 0.0112 0.1154 0.2872
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.0418 0.0976
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.0418 0.1002
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.02 0.0448
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0264 0.0668
Loa Loa (eye worm) hypothetical protein 0.0048 0.0407 0.1029
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0063 0.0584 0.0551
Schistosoma mansoni hypothetical protein 0.0017 0.0035 0.0029
Trichomonas vaginalis CAMK family protein kinase 0.01 0.1021 0.1995
Echinococcus granulosus geminin 0.0171 0.1851 0.4629
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0346 0.0312
Schistosoma mansoni hypothetical protein 0.0017 0.0035 0.0029
Loa Loa (eye worm) beta-lactamase 0.0038 0.0289 0.0729
Schistosoma mansoni kinase 0.0103 0.1052 0.2615
Loa Loa (eye worm) hypothetical protein 0.0049 0.0418 0.1056
Trypanosoma brucei N-myristoyltransferase 0.035 0.3958 1
Loa Loa (eye worm) MBCTL1 0.0056 0.0498 0.1259
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0541 0.2964
Echinococcus granulosus apoptotic protease activating factor 1 0.0033 0.0225 0.0483
Echinococcus multilocularis cpg binding protein 0.0033 0.023 0.0196
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0289 0.5
Trichomonas vaginalis N-myristoyl transferase, putative 0.023 0.2545 0.6149
Brugia malayi Cell death protein 3 precursor 0.0033 0.0225 0.0568
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0631 0.1545
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0132 0.0275
Onchocerca volvulus Huntingtin homolog 0.0257 0.2863 1
Entamoeba histolytica glycylpeptide N-tetradecanoyltransferase, putative 0.035 0.3958 1
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0631 0.1545
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0203 0.0026
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0179 0.0367
Schistosoma mansoni cpg binding protein 0.003 0.0187 0.0415
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0346 0.0792
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0194 0.2125 0.5326
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0289 0.0236
Schistosoma mansoni hypothetical protein 0.0031 0.0203 0.0456
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0938 0.2323
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0203 0.0427
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0323 0.0761
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0045 0.0054
Trypanosoma cruzi polo-like protein kinase, putative 0.0203 0.2228 0.5603
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0063 0.0584 0.1399
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.0418 0.1056
Brugia malayi hypothetical protein 0.0033 0.0225 0.0568
Onchocerca volvulus Serine\/threonine kinase homolog 0.0203 0.2228 0.7626
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0112 0.1154 0.1122
Echinococcus multilocularis geminin 0.0171 0.1851 0.1822
Loa Loa (eye worm) hypothetical protein 0.0033 0.0225 0.0568
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0057 0.0084
Echinococcus multilocularis caspase 2 0.0033 0.0225 0.019
Brugia malayi jmjC domain containing protein 0.0102 0.1034 0.2613
Trichomonas vaginalis CAMK family protein kinase 0.0203 0.2228 0.5286
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0048 0.0407 0.0373
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0938 0.23
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.0592 0.1444
Brugia malayi jmjC domain containing protein 0.0041 0.0323 0.0816
Brugia malayi RNA recognition motif domain containing protein 0.0067 0.0631 0.1595
Onchocerca volvulus 0.0038 0.0289 0.038

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.2944 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 33.8078 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 70.7946 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

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

No literature references available for this target.

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