Detailed information for compound 1476041

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 362.427 | Formula: C24H18N4
  • H donors: 1 H acceptors: 3 LogP: 4.9 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)C1=NN=C(c2c(N1)c1ccccc1cc2)c1ccncc1
  • InChi: 1S/C24H18N4/c1-16-6-8-19(9-7-16)24-26-23-20-5-3-2-4-17(20)10-11-21(23)22(27-28-24)18-12-14-25-15-13-18/h2-15H,1H3,(H,26,28)
  • InChiKey: PXVSWMUZYURFDX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens neuropeptide S receptor 1 Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens RAN, member RAS oncogene family No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens signal transducer and activator of transcription 1, 91kDa Starlite/ChEMBL No references
Homo sapiens snurportin 1 No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum GTP-binding nuclear protein Ran, related Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Brugia malayi GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Entamoeba histolytica Ran family GTPase Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva GTP-binding nuclear protein ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis GTP-binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Get druggable targets OG5_136011 All targets in OG5_136011
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania infantum GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania donovani GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium yoelii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma congolense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania braziliensis GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania major GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus growth factor receptor bound protein 2 0.0011 0.0001 0.0001
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0154 0.1352 0.3391
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0149 0.13 0.13
Echinococcus granulosus tyrosine protein kinase Src42A 0.0039 0.0261 0.0261
Echinococcus multilocularis tyrosine protein kinase HCK 0.0033 0.0204 0.0204
Brugia malayi Heterochromatin protein 1 0.0084 0.0691 0.1732
Onchocerca volvulus 0.0157 0.1376 0.3451
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0434 0.3987 1
Schistosoma mansoni chromobox protein 0.0014 0.0027 0.0068
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0376 0.088
Brugia malayi chromobox protein homolog 3 0.0047 0.0342 0.0858
Schistosoma mansoni brg-1 associated factor 0.0434 0.3987 1
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0835 0.7768 0.7768
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0.0139 0.5
Schistosoma mansoni hypothetical protein 0.0154 0.1352 0.3391
Schistosoma mansoni chromobox protein 0.0014 0.0027 0.0068
Schistosoma mansoni RNA binding protein 0.0154 0.1352 0.3391
Loa Loa (eye worm) hypothetical protein 0.0154 0.1352 0.3391
Brugia malayi Importin beta-1 subunit 0.0035 0.0226 0.0566
Trichomonas vaginalis ran, putative 0.0026 0.0139 0.0282
Onchocerca volvulus 0.0014 0.0027 0.0068
Onchocerca volvulus 0.0286 0.2594 0.6506
Trypanosoma brucei hypothetical protein, conserved 0.0154 0.1352 1
Brugia malayi Pre-SET motif family protein 0.0036 0.0237 0.0595
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0237 0.0237
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.2267 0.5685
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Echinococcus multilocularis growth factor receptor bound protein 2 0.0011 0.0001 0.0001
Plasmodium vivax importin-beta 2, putative 0.0035 0.0226 0.0501
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.0434 0.3987 0.3987
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Schistosoma mansoni hypothetical protein 0.0434 0.3987 1
Echinococcus multilocularis Chromobox protein 3 0.0014 0.0027 0.0027
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0154 0.1352 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0246 0.0617
Echinococcus multilocularis geminin 0.0205 0.1827 0.1827
Echinococcus multilocularis snurportin 1 0.0372 0.3402 0.3402
Brugia malayi RNA, U transporter 1 0.0099 0.0831 0.2084
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0012 0.0012 0.0012
Trichomonas vaginalis set domain proteins, putative 0.0286 0.2594 0.6482
Onchocerca volvulus 0.0037 0.0246 0.0617
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Trypanosoma cruzi WLM domain containing protein, putative 0.0154 0.1352 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0001 0.0004
Brugia malayi YY1-associated factor 2 0.0154 0.1352 0.3391
Entamoeba histolytica protein kinase, putative 0.0033 0.0204 1
Echinococcus granulosus chromobox protein 1 0.0084 0.0691 0.0691
Schistosoma mansoni tyrosine kinase 0.0044 0.0309 0.0774
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0044 0.0309 0.0309
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0376 0.088
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.0376 0.0942
Brugia malayi Tyrosine-protein kinase abl-1 0.0012 0.0012 0.003
Schistosoma mansoni chromobox protein 0.0084 0.0691 0.1732
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0026 0.0139 0.0282
Echinococcus multilocularis tumor protein p63 0.1071 1 1
Schistosoma mansoni hypothetical protein 0.0149 0.13 0.3261
Onchocerca volvulus 0.0154 0.1352 0.3391
Schistosoma mansoni adapter molecule crk 0.0011 0.0001 0.0004
Trichomonas vaginalis conserved hypothetical protein 0.0434 0.3987 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.0342 0.0858
Plasmodium vivax SET domain protein, putative 0.0036 0.0237 0.053
Brugia malayi STAT protein, DNA binding domain containing protein 0.0163 0.1433 0.3594
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0154 0.1352 0.3391
Echinococcus granulosus tyrosine protein kinase HCK 0.0033 0.0204 0.0204
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0212 0.0467
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0039 0.0261 0.0261
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0154 0.1352 0.3391
Loa Loa (eye worm) SRC-1 0.0044 0.0309 0.0774
Loa Loa (eye worm) hypothetical protein 0.0035 0.0226 0.0566
Echinococcus granulosus SWI:SNF matrix associated 0.0434 0.3987 0.3987
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0163 0.0344
Brugia malayi SRC-1 0.0044 0.0309 0.0774
Echinococcus granulosus NCK adaptor protein 0.0011 0.0001 0.0001
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0044 0.0309 0.0309
Echinococcus granulosus tyrosine kinase 0.004 0.0271 0.0271
Echinococcus granulosus chromobox protein 1 0.0084 0.0691 0.0691
Echinococcus multilocularis tyrosine protein kinase Srms 0.004 0.0271 0.0271
Echinococcus granulosus geminin 0.0205 0.1827 0.1827
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0154 0.1352 1
Chlamydia trachomatis SWIB complex protein 0.0434 0.3987 0.5
Brugia malayi brahma associated protein 60 kDa 0.0434 0.3987 1
Leishmania major importin beta-1 subunit, putative 0.0028 0.0163 0.0203
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.0434 0.3987 1
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0434 0.3987 1
Plasmodium falciparum importin beta, putative 0.0035 0.0226 0.0501
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0237 0.0237
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0014 0.0027 0.0027
Brugia malayi SWIB/MDM2 domain containing protein 0.0434 0.3987 1
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0154 0.1352 0.3391
Echinococcus granulosus importin subunit beta 1 0.0035 0.0226 0.0226
Entamoeba histolytica Ran family GTPase 0.0026 0.0139 0.6304
Entamoeba histolytica hypothetical protein 0.0028 0.0163 0.7691
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0835 0.7768 0.7768
Echinococcus granulosus ring and YY1 binding protein 0.0154 0.1352 0.1352
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0226 0.0714
Onchocerca volvulus Ubiquitin thioesterase ZRANB1 homolog 0.0154 0.1352 0.3391
Onchocerca volvulus 0.0014 0.0027 0.0068
Echinococcus multilocularis tyrosine protein kinase Fyn 0.004 0.0271 0.0271
Echinococcus granulosus GTP binding nuclear protein Ran 0.0026 0.0139 0.0139
Echinococcus multilocularis c src tyrosine kinase 0.0012 0.0012 0.0012
Schistosoma mansoni hypothetical protein 0.0149 0.13 0.3261
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0149 0.13 0.3261
Loa Loa (eye worm) TK protein kinase 0.0033 0.0204 0.0513
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0014 0.0027 0.0068
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0163 0.0203
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.3402 0.8532
Brugia malayi brahma associated protein 60 kDa 0.0434 0.3987 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0237 0.0595
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0342 0.0795
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0226 0.0714
Schistosoma mansoni tyrosine kinase 0.0044 0.0309 0.0774
Brugia malayi M-phase phosphoprotein, mpp8 0.0014 0.0027 0.0068
Loa Loa (eye worm) hypothetical protein 0.0157 0.1376 0.3451
Trypanosoma brucei hypothetical protein, conserved 0.0154 0.1352 1
Brugia malayi Pre-SET motif family protein 0.0251 0.2267 0.5685
Toxoplasma gondii ran binding protein 0.0154 0.1352 0.3346
Schistosoma mansoni zinc finger protein 0.0154 0.1352 0.3391
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0691 0.1675
Schistosoma mansoni growth factor receptor-bound protein 0.0011 0.0001 0.0004
Echinococcus multilocularis chromobox protein 2 0.0014 0.0027 0.0027
Loa Loa (eye worm) hypothetical protein 0.0036 0.0237 0.0595
Schistosoma mansoni TRABID protein (C64 family) 0.0154 0.1352 0.3391
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0237 0.053
Schistosoma mansoni hypothetical protein 0.0205 0.1827 0.4581
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0237 0.0595
Onchocerca volvulus 0.0434 0.3987 1
Echinococcus granulosus tyrosine protein kinase Src64B 0.0044 0.0309 0.0309
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0012 0.0012 0.0012
Schistosoma mansoni growth factor receptor-bound protein 0.0011 0.0001 0.0004
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0237 0.0595
Echinococcus granulosus Chromo domain 0.0014 0.0027 0.0027
Echinococcus multilocularis SWI:SNF matrix associated 0.0434 0.3987 0.3987
Echinococcus granulosus neuropeptide receptor A26 0.0558 0.5163 0.5163
Echinococcus multilocularis Nuclear pore complex protein Nup153 0.0154 0.1352 0.1352
Echinococcus multilocularis ring and YY1 binding protein 0.0154 0.1352 0.1352
Schistosoma mansoni cellular tumor antigen P53 0.0157 0.1376 0.3451
Loa Loa (eye worm) helicase 0.0014 0.0027 0.0068
Loa Loa (eye worm) CHromoDomain protein family member 0.0014 0.0027 0.0068
Loa Loa (eye worm) hypothetical protein 0.0154 0.1352 0.3391
Brugia malayi Associated with TFs and helicases family protein 0.0014 0.0027 0.0068
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0014 0.0027 0.0068
Echinococcus granulosus tyrosine protein kinase Src42A 0.0044 0.0309 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.005 0.0367 0.092
Echinococcus multilocularis NCK adaptor protein 0.0011 0.0001 0.0001
Echinococcus granulosus c src tyrosine kinase 0.0012 0.0012 0.0012
Brugia malayi Variant SH3 domain containing protein 0.0011 0.0001 0.0004
Plasmodium vivax hypothetical protein, conserved 0.0434 0.3987 1
Schistosoma mansoni apoptosis regulator bax 0.0149 0.13 0.3261
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0163 0.0344
Echinococcus granulosus Nuclear pore complex protein Nup153 0.0154 0.1352 0.1352
Schistosoma mansoni hypothetical protein 0.0434 0.3987 1
Echinococcus granulosus neuropeptide s receptor 0.0558 0.5163 0.5163
Loa Loa (eye worm) hypothetical protein 0.0154 0.1352 0.3391
Plasmodium falciparum zinc finger Ran-binding domain-containing protein 2, putative 0.0154 0.1352 0.3346
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0014 0.0027 0.0068
Chlamydia trachomatis DNA topoisomerase I 0.0434 0.3987 0.5
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0226 0.0226
Schistosoma mansoni tyrosine kinase 0.0012 0.0012 0.003
Echinococcus multilocularis Zinc finger, RanBP2 type 0.0154 0.1352 0.1352
Echinococcus granulosus zinc finger protein Ran binding 0.0154 0.1352 0.1352
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0014 0.0027 0.0027
Onchocerca volvulus 0.0154 0.1352 0.3391
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0139 0.0282
Loa Loa (eye worm) brahma associated protein 0.0434 0.3987 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0068
Leishmania major hypothetical protein, conserved 0.0154 0.1352 1
Echinococcus granulosus snurportin 1 0.0372 0.3402 0.3402
Schistosoma mansoni hypothetical protein 0.0014 0.0027 0.0068
Schistosoma mansoni importin beta-1 0.0035 0.0226 0.0566
Trypanosoma cruzi hypothetical protein, conserved 0.0154 0.1352 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.1352 0.3391
Brugia malayi SET domain containing protein 0.0015 0.004 0.0099
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0014 0.0027 0.0027
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0237 0.0237
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0044 0.0309 0.0309
Echinococcus granulosus tyrosine protein kinase Lyn 0.0044 0.0309 0.0309
Echinococcus multilocularis tyrosine protein kinase Blk 0.004 0.0271 0.0271
Schistosoma mansoni nck2/grb4 0.0011 0.0001 0.0004
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0026 0.0139 0.0282
Brugia malayi protein-tyrosine kinase 0.004 0.0271 0.068
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0011 0.0001 0.0004
Echinococcus multilocularis chromobox protein 1 0.0084 0.0691 0.0691
Schistosoma mansoni hypothetical protein 0.0372 0.3402 0.8532
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0212 0.0467
Brugia malayi Protein cec-1. 0.0014 0.0027 0.0068
Echinococcus granulosus tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0434 0.3987 1
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0044 0.0309 0.0309
Leishmania major hypothetical protein, conserved 0.0154 0.1352 1
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0154 0.1352 1
Schistosoma mansoni ran 0.0026 0.0139 0.0348
Onchocerca volvulus 0.0154 0.1352 0.3391
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0225 0.0225
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0149 0.13 0.3261
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0012 0.0012 0.003
Schistosoma mansoni ran 0.0026 0.0139 0.0348
Brugia malayi Valyl-tRNA synthetase 0.0014 0.0027 0.0068
Echinococcus multilocularis neuropeptide receptor A26 0.0558 0.5163 0.5163
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0014 0.0027 0.0027
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.004 0.0271 0.0271
Echinococcus granulosus Chromobox protein 3 0.0014 0.0027 0.0027
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0044 0.0309 0.0309
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0026 0.0139 0.0348
Echinococcus multilocularis neuropeptide s receptor 0.0558 0.5163 0.5163
Echinococcus granulosus tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0044 0.0309 0.0309
Brugia malayi Variant SH3 domain containing protein 0.0011 0.0001 0.0004
Loa Loa (eye worm) hypothetical protein 0.0154 0.1352 0.3391
Trypanosoma cruzi hypothetical protein, conserved 0.0154 0.1352 1
Echinococcus multilocularis SWI:SNF matrix associated 0.0434 0.3987 0.3987
Loa Loa (eye worm) TK protein kinase 0.004 0.0271 0.068
Trypanosoma cruzi WLM domain containing protein, putative 0.0154 0.1352 1
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0014 0.0027 0.0068
Echinococcus multilocularis tyrosine protein kinase Abl 0.0012 0.0012 0.0012
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0044 0.0309 0.0309
Brugia malayi Sex muscle abnormal protein 5 0.0011 0.0001 0.0004
Onchocerca volvulus 0.0154 0.1352 0.3391
Toxoplasma gondii Zn-finger in Ran binding protein and others domain-containing protein 0.0154 0.1352 0.3346
Schistosoma mansoni hypothetical protein 0.0149 0.13 0.3261
Schistosoma mansoni hypothetical protein 0.0434 0.3987 1
Echinococcus multilocularis chromobox protein 1 0.0084 0.0691 0.0691
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0026 0.0139 0.0139
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0044 0.0309 0.0309
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0226 0.0501
Echinococcus multilocularis zinc finger protein Ran binding 0.0154 0.1352 0.1352
Loa Loa (eye worm) hypothetical protein 0.0149 0.13 0.3261
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0691 0.1675
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0154 0.1352 1
Brugia malayi CHD4 protein 0.0014 0.0027 0.0068
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.0691 0.1732
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0026 0.0139 0.0348
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0154 0.1352 1
Schistosoma mansoni hypothetical protein 0.0205 0.1827 0.4581
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Loa Loa (eye worm) apoptosis regulator protein 0.0149 0.13 0.3261
Echinococcus multilocularis Chromo domain 0.0014 0.0027 0.0027
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0163 0.0344
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0154 0.1352 1
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0011 0.0001 0.0004
Echinococcus granulosus Zinc finger RanBP2 type 0.0154 0.1352 0.1352
Leishmania major hypothetical protein, conserved 0.0154 0.1352 1
Leishmania major hypothetical protein, conserved 0.0154 0.1352 1
Schistosoma mansoni chromobox protein 0.0084 0.0691 0.1732
Echinococcus multilocularis SWI:SNF matrix associated 0.0434 0.3987 0.3987
Echinococcus granulosus tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Brugia malayi hypothetical protein 0.0014 0.0027 0.0068
Loa Loa (eye worm) STAT protein 0.0163 0.1433 0.3594
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0154 0.1352 1
Schistosoma mansoni fusion 0.0154 0.1352 0.3391
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0342 0.0795
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0011 0.0001 0.0004
Trypanosoma cruzi hypothetical protein, conserved 0.0154 0.1352 1
Echinococcus granulosus chromobox protein 2 0.0014 0.0027 0.0027
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0434 0.3987 1
Onchocerca volvulus 0.005 0.0367 0.092
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0014 0.0027 0.0068
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0044 0.0309 0.0309
Echinococcus granulosus Upstream activation factor subunit UAF30 0.0434 0.3987 0.3987
Echinococcus granulosus tyrosine protein kinase Blk 0.004 0.0271 0.0271
Loa Loa (eye worm) hypothetical protein 0.0047 0.0342 0.0858
Schistosoma mansoni tyrosine kinase 0.0012 0.0012 0.003
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0149 0.13 0.13
Leishmania major hypothetical protein, conserved 0.0154 0.1352 1
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0434 0.3987 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 3.517 um PUBCHEM_BIOASSAY: Dose response cell-based assay to measure STAT1 inhibition. (Class of assay: confirmatory) [Related pubchem assays: 1263, 920, 862, 1303, 1310 ] ChEMBL. No reference
IC50 (functional) > 55.7 um PUBCHEM_BIOASSAY: Dose response counterscreen for STAT1 inhibitors: cell-based high throughput assay to measure STAT3 inhibition. (Class of assay: confirmatory) [Related pubchem assays: 920, 1310, 1263, 862, 1303 ] ChEMBL. No reference
Potency (functional) 0.5012 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.5131 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 14.1254 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 18.3564 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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) 20.5962 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of Mitochondrial Division or Activators of Mitochondrial Fusion. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (binding) = 28.1838 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (binding) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Compounds Blocking the Interaction Between CBF-beta and RUNX1 for the Treatment of Acute Myeloid Leukemia. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1484, AID504370, AID504374, AID504375] ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (binding) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Tyrosyl-DNA Phosphodiesterase (TDP1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay; Stimulation with EGF. (Class of assay: confirmatory) [Related pubchem assays: 995 ] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) = 89.1251 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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