Detailed information for compound 1650531

Basic information

Technical information
  • TDR Targets ID: 1650531
  • Name: NCI60_008056
  • MW: 461.596 | Formula: C28H35N3O3
  • H donors: 1 H acceptors: 1 LogP: 4.66 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(ccc1[C@]1(C[C@@H]2CCCN(C2)CCc2c1[nH]c1c2cccc1)C(=O)OC)N(C)C
  • InChi: 1S/C28H35N3O3/c1-30(2)20-11-12-23(25(16-20)33-3)28(27(32)34-4)17-19-8-7-14-31(18-19)15-13-22-21-9-5-6-10-24(21)29-26(22)28/h5-6,9-12,16,19,29H,7-8,13-15,17-18H2,1-4H3/t19-,28-/m0/s1
  • InChiKey: PIFNLEHBGRNRKU-VKGTZQKMSA-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
Trypanosoma brucei poly(adp-ribose) polymerase 0.002 0.1308 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin 2,3/unc44, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) hypothetical protein 0.0009 0.0496 0.0545
Echinococcus multilocularis Ankyrin 0.0002 0.000000096934 0.000000097072
Brugia malayi hypothetical protein 0.0013 0.0758 0.0766
Trichomonas vaginalis fibronectin type 3 and ankyrin repeat domains, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0002 0.0014 0.0109
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0007 0.0375 0.5
Trichomonas vaginalis ion channel nompc, putative 0.0002 0.0001 0.0011
Echinococcus granulosus cytochrome P450 2K1 0.0007 0.0375 0.0375
Trichomonas vaginalis ankyrin repeat domain-containing protein, putative 0.0002 0.0001 0.0011
Trypanosoma cruzi palmitoyl acyltransferase 1, putative 0.0002 0.0014 0.0109
Giardia lamblia Kinase, NEK 0.0002 0.000000096934 0.0001
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ion channel nompc, putative 0.0002 0.0014 0.0109
Entamoeba histolytica zinc finger protein, putative 0.002 0.1308 1
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0007 0.0375 0.5
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Entamoeba histolytica hypothetical protein 0.002 0.1308 1
Loa Loa (eye worm) tnks protein 0.0131 0.9103 1
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0758 0.5796
Trichomonas vaginalis cortactin-binding protein, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) cytochrome P450 family protein 0.0027 0.1755 0.1928
Echinococcus granulosus tankyrase 0.0143 0.9986 1
Entamoeba histolytica ankyrin repeat protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis cask-interacting protein (caskin) 1,2, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma cruzi cytochrome P450, putative 0.0016 0.1009 0.7708
Brugia malayi Tnks protein 0.0142 0.9899 1
Brugia malayi WGR domain containing protein 0.002 0.1308 0.1322
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Schistosoma mansoni lip-related protein (liprin) alpha 0.0013 0.0758 0.0758
Onchocerca volvulus Tankyrase homolog 0.0129 0.8951 1
Leishmania major cytochrome p450-like protein 0.0016 0.1009 1
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis protein phosphatase 1 regulatory subunit 12B, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis multiple ankyrin repeats single kh domain protein, putative 0.0002 0.0014 0.0109
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0007 0.0375 0.5
Trichomonas vaginalis unc-44 ankyrins, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.002 0.1308 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0007 0.0375 0.5
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis serine/threonine-protein kinase ripk4, putative 0.0002 0.0001 0.0011
Schistosoma mansoni cytochrome P450 0.0007 0.0375 0.0375
Trichomonas vaginalis c2h2 zinc finger protein, putative 0.0013 0.0758 0.5796
Loa Loa (eye worm) hypothetical protein 0.0013 0.0758 0.0833
Echinococcus multilocularis SAM domain containing protein 0.0013 0.0758 0.0759
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) hypothetical protein 0.0108 0.7519 0.826
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin, putative 0.0002 0.000000096934 0.0000007409
Echinococcus granulosus liprin alpha 2 0.0013 0.0758 0.0759
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma brucei Ankyrin repeats (many copies), putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) cytochrome P450 family protein 0.0016 0.1009 0.1108
Schistosoma mansoni poly [ADP-ribose] polymerase 0.002 0.1308 0.1308
Brugia malayi Cytochrome P450 family protein 0.0016 0.1009 0.1019
Loa Loa (eye worm) hypothetical protein 0.0013 0.0758 0.0833
Loa Loa (eye worm) hypothetical protein 0.0013 0.0758 0.0833
Trichomonas vaginalis multiple ankyrin repeats single kh domain protein, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma brucei cytochrome P450, putative 0.0016 0.1009 0.7708
Loa Loa (eye worm) Notch2 0.0002 0.0001 0.0002
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.002 0.1308 1
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0007 0.0375 0.5
Loa Loa (eye worm) hypothetical protein 0.0002 0.000000096934 0.00000010649
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0007 0.0375 0.5
Plasmodium vivax tyrosine kinase-like protein, putative 0.0013 0.0758 0.5
Brugia malayi Cytochrome P450 family protein 0.0016 0.1009 0.1019
Trichomonas vaginalis conserved hypothetical protein 0.0002 0.000000096934 0.0000007409
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0007 0.0375 0.5
Trichomonas vaginalis ankyrin, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis ion channel nompc, putative 0.0002 0.000000096934 0.0000007409
Echinococcus multilocularis liprin alpha 2 0.0013 0.0758 0.0759
Echinococcus granulosus Sterile alpha motif SAM 0.0013 0.0758 0.0759
Echinococcus granulosus 26S proteasome non ATPase regulatory subunit 10 0.0002 0.0001 0.0001
Brugia malayi Cytochrome P450 family protein 0.0027 0.1755 0.1773
Echinococcus multilocularis poly (adp ribose) polymerase 2 0.002 0.1308 0.131
Leishmania major huntingtin interacting protein (HIP), putative 0.0002 0.0014 0.0141
Giardia lamblia Kinase, NEK 0.0002 0.0014 1
Echinococcus multilocularis liprin beta 1 0.0013 0.0758 0.0759
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis 26S proteasome non-ATPase regulatory subunit, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Loa Loa (eye worm) poly(ADP-ribose) polymerase 0.002 0.1308 0.1437
Trichomonas vaginalis ankyrin repeat and sam domain-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin 2,3/unc44, putative 0.0003 0.0054 0.0411
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0758 0.5796
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-rich membrane-spanning protein, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis ion channel nompc, putative 0.0002 0.0001 0.0011
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0007 0.0375 0.2863
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Onchocerca volvulus 0.0013 0.0758 0.0847
Loa Loa (eye worm) hypothetical protein 0.0002 0.000000096934 0.00000010649
Giardia lamblia Kinase, NEK-frag 0.0002 0.000000096934 0.0001
Trichomonas vaginalis ankyrin repeat and FYVE domain containing protein, putative 0.0002 0.0014 0.0109
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Giardia lamblia Kinase, NEK 0.0002 0.0014 1
Plasmodium falciparum protein kinase, putative 0.0013 0.0758 0.5
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Brugia malayi Cytochrome P450 family protein 0.0007 0.0375 0.0378
Schistosoma mansoni hypothetical protein 0.0013 0.0758 0.0758
Echinococcus granulosus Ankyrin 0.0002 0.0014 0.0014
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0007 0.0375 0.2863
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0007 0.0375 0.3714
Onchocerca volvulus 0.0013 0.0758 0.0847
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) hypothetical protein 0.0002 0.000000096934 0.00000010649
Loa Loa (eye worm) hypothetical protein 0.002 0.1308 0.1437
Toxoplasma gondii Tyrosine kinase-like (TKL) protein 0.0013 0.0758 0.5796
Schistosoma mansoni 26S proteasome subunit 0.0002 0.000000096934 0.000000096934
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0758 0.5796
Schistosoma mansoni sarm1 0.0013 0.0758 0.0758
Brugia malayi Patatin-like phospholipase family protein 0.0002 0.000000096934 0.000000097923
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0007 0.0375 0.5
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0007 0.0375 0.5
Entamoeba histolytica hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis ion channel nompc, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis nf kappa B inhibitor I-kappa-B, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma brucei palmitoyl acyltransferase 1, putative 0.0002 0.0014 0.0109
Echinococcus granulosus poly ADP ribose polymerase 1 0.002 0.1308 0.131
Echinococcus granulosus poly adp ribose polymerase 2 0.002 0.1308 0.131
Echinococcus granulosus liprin beta 1 0.0013 0.0758 0.0759
Trichomonas vaginalis ankyrin repeat-rich membrane-spanning protein, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma cruzi palmitoyl acyltransferase 1, putative 0.0002 0.0014 0.0109
Schistosoma mansoni ankyrin 23/unc44 0.0002 0.0014 0.0014
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0002 0.000000096934 0.0000007409
Entamoeba histolytica hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Schistosoma mansoni hypothetical protein 0.0013 0.0758 0.0758
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Leishmania major cytochrome p450-like protein 0.0007 0.0375 0.3714
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0007 0.0375 0.2863
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis inversin, putative 0.0002 0.0001 0.0011
Echinococcus granulosus E3 ubiquitin protein ligase mib1 0.0002 0.0014 0.0014
Echinococcus multilocularis 0.0007 0.0375 0.0375
Loa Loa (eye worm) hypothetical protein 0.0002 0.000000096934 0.00000010649
Trichomonas vaginalis sex-determining protein fem-1, putative 0.0002 0.000000096934 0.0000007409
Plasmodium falciparum tyrosine kinase-like protein 0.0013 0.0758 0.5
Schistosoma mansoni lar interacting protein (lip)-related protein 0.0013 0.0758 0.0758
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0002 0.0001 0.0011
Brugia malayi Liprin-alpha 2 0.0013 0.0758 0.0766
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0007 0.0375 0.5
Echinococcus multilocularis stromal interaction molecule 1 0.0013 0.0758 0.0759
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) cytochrome P450 family protein 0.0016 0.1009 0.1108
Brugia malayi Neurabin protein 1 0.0013 0.0758 0.0766
Giardia lamblia Protein 21.1 0.0002 0.000000096934 0.0001
Trichomonas vaginalis ankyrin, putative 0.0002 0.0016 0.012
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0007 0.0375 0.5
Schistosoma mansoni hypothetical protein 0.0013 0.0758 0.0758
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0007 0.0375 0.5
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0007 0.0375 0.5
Mycobacterium leprae putative cytochrome p450 0.0007 0.0375 0.5
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Brugia malayi hypothetical protein 0.0013 0.0758 0.0766
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0758 0.5796
Trichomonas vaginalis homeobox-containing protein wariai, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Trypanosoma cruzi ankyrin repeat protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Echinococcus multilocularis sterile alpha and tir motif containing protein 0.0013 0.0758 0.0759
Echinococcus granulosus Ankyrin 0.0002 0.000000096934 0.000000097072
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Toxoplasma gondii cytochrome p450 superfamily protein 0.0007 0.0375 0.2863
Giardia lamblia Ankyrin 1 0.0002 0.000000096934 0.0001
Echinococcus multilocularis ankyrin repeat domain containing protein 6 0.0002 0.000000096934 0.000000097072
Echinococcus multilocularis E3 ubiquitin protein ligase mib1 0.0002 0.0014 0.0014
Echinococcus multilocularis tankyrase 0.0143 0.9986 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Brugia malayi WGR domain containing protein 0.002 0.1308 0.1322
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis protein phosphatase 1 regulatory subunit 12B, putative 0.0002 0.0001 0.0011
Loa Loa (eye worm) toll and interleukin 1 receptor domain-containing protein isoform f 0.0013 0.0758 0.0833
Echinococcus multilocularis poly (ADP ribose) polymerase 0.002 0.1308 0.131
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0016 0.1009 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Brugia malayi coiled-coil like protein 1 0.0013 0.0758 0.0766
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis unc-44 ankyrins, putative 0.0002 0.0014 0.0109
Loa Loa (eye worm) hypothetical protein 0.0002 0.0016 0.0017
Schistosoma mansoni hypothetical protein 0.0013 0.0758 0.0758
Trichomonas vaginalis ankyrin repeat and FYVE domain containing protein, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0014 0.0109
Schistosoma mansoni phospholipase 0.0002 0.000000096934 0.000000096934
Trypanosoma cruzi cytochrome P450, putative 0.0016 0.1009 0.7708
Brugia malayi Patatin-like phospholipase family protein 0.0002 0.0014 0.0014
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0007 0.0375 0.5
Trichomonas vaginalis ankyrin, putative 0.0002 0.0014 0.0109
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0007 0.0375 0.5
Trichomonas vaginalis 2-5A-dependent ribonuclease, putative 0.0002 0.0014 0.0109
Echinococcus granulosus stromal interaction molecule 1 0.0013 0.0758 0.0759
Schistosoma mansoni hypothetical protein 0.0007 0.0375 0.0375
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Brugia malayi Leucine Rich Repeat family protein 0.0002 0.000000096934 0.000000097923
Echinococcus multilocularis Ankyrin 0.0002 0.0016 0.0016
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0007 0.0375 0.5
Echinococcus granulosus sterile alpha and tir motif containing protein 0.0013 0.0758 0.0759
Loa Loa (eye worm) hypothetical protein 0.0013 0.0758 0.0833
Trichomonas vaginalis E3 ubiquitin protein ligase, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis ankyrin, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis ankyrin, putative 0.0002 0.0001 0.0011
Brugia malayi sterile alpha and TIR motif containing protein 1 isoform a 0.0013 0.0758 0.0766
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0007 0.0375 0.5
Trichomonas vaginalis fetal globin-inducing factor, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0002 0.0014 0.0109
Trichomonas vaginalis 2-5A-dependent ribonuclease, putative 0.0002 0.000000096934 0.0000007409
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.0016 0.012
Echinococcus granulosus SAM domain containing protein 0.0013 0.0758 0.0759
Giardia lamblia Kinase, NEK 0.0002 0.000000096934 0.0001
Schistosoma mansoni ga binding protein beta chain (transcription factor e4tf1-47) 0.0002 0.000000096934 0.000000096934
Trichomonas vaginalis ankyrin 2,3/unc44, putative 0.0002 0.0014 0.0109
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Loa Loa (eye worm) cytochrome P450 0.0007 0.0375 0.0411
Echinococcus multilocularis poly (ADP ribose) polymerase 1 0.002 0.1308 0.131
Trichomonas vaginalis mind bomb, putative 0.0002 0.000000096934 0.0000007409
Brugia malayi Uncoordinated protein 44 0.0002 0.0001 0.0002
Loa Loa (eye worm) hypothetical protein 0.0013 0.0758 0.0833
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0007 0.0375 0.5
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0007 0.0375 0.5
Leishmania major cytochrome p450-like protein 0.0007 0.0375 0.3714
Entamoeba histolytica poly(ADP-ribose) polymerase, putative 0.002 0.1308 1
Schistosoma mansoni poly [ADP-ribose] polymerase 0.002 0.1308 0.1308
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0003 0.004 0.0303
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.002 0.1308 1
Giardia lamblia Protein 21.1 0.0002 0.000000096934 0.0001
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0002 0.0038 0.0291
Loa Loa (eye worm) CYP4Cod1 0.0016 0.1009 0.1108
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0002 0.000000096934 0.0000007409
Brugia malayi cytochrome P450 0.0007 0.0375 0.0378
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0007 0.0375 0.5
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0007 0.0375 0.2863
Trichomonas vaginalis conserved hypothetical protein 0.002 0.1308 1
Trichomonas vaginalis protein phosphatase 1 regulatory subunit 12C, putative 0.0002 0.0014 0.0109
Trichomonas vaginalis tankyrase, putative 0.0002 0.0001 0.0011
Trichomonas vaginalis 2-5A-dependent ribonuclease, putative 0.0002 0.000000096934 0.0000007409
Mycobacterium leprae Conserved hypothetical protein 0.0007 0.0375 0.5
Trichomonas vaginalis unc-44 ankyrins, putative 0.0002 0.0014 0.0109
Echinococcus multilocularis 26S proteasome non ATPase regulatory subunit 10 0.0002 0.0001 0.0001
Trichomonas vaginalis rolling pebbles, putative 0.0002 0.000000096934 0.0000007409
Entamoeba histolytica hypothetical protein 0.002 0.1308 1

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.97 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.933 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.81 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.799 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.776 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the P388 Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.765 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.723 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.715 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.688 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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