Detailed information for compound 1203826

Basic information

Technical information
  • TDR Targets ID: 1203826
  • Name: 8-cyclopropyl-2-(4-methoxyphenoxy)pteridin-7- one
  • MW: 310.307 | Formula: C16H14N4O3
  • H donors: 0 H acceptors: 3 LogP: 1.89 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)Oc1ncc2c(n1)n(C1CC1)c(=O)cn2
  • InChi: 1S/C16H14N4O3/c1-22-11-4-6-12(7-5-11)23-16-18-8-13-15(19-16)20(10-2-3-10)14(21)9-17-13/h4-10H,2-3H2,1H3
  • InChiKey: BITCZCUZMFHHJH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 8-cyclopropyl-2-(4-methoxyphenoxy)-7-pteridinone
  • NCGC00011116
  • PCOP-371493

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ubiquitin specific peptidase 2 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 19 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 1, subfamily A, polypeptide 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Candida albicans ubiquitin-specific protease Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania infantum ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma congolense ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium parvum ubiquitin C-terminal hydrolase of the cysteine proteinase fold Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania mexicana ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum ko:K01072 ubiquitin thiolesterase [EC3.1.2.15], putative Get druggable targets OG5_127431 All targets in OG5_127431
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania donovani ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania braziliensis ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium hominis ubiquitin specific protease 66 Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei gambiense ubiquitin carboxyl-terminal hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR001394,Peptidase C19, ubiquitin carboxyl-terminal hydrolase 2,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR015063,Domain of unknown function DUF1873,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum expressed protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Leishmania major cytochrome p450-like protein cytochrome P450, family 2, subfamily C, polypeptide 19 490 aa 411 aa 23.1 %
Plasmodium falciparum ubiquitin specific protease, putative ubiquitin specific peptidase 2 362 aa 378 aa 25.7 %
Brugia malayi Cytochrome P450 family protein cytochrome P450, family 1, subfamily A, polypeptide 2 516 aa 470 aa 26.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0045 0.6944 0.6943
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0009 0.0837 0.5
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0009 0.0837 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.7357 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase 2, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus granulosus cytochrome P450 2K1 0.0009 0.0837 0.1136
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0045 0.6944 0.9437
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.7357 0.7357
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium leprae putative cytochrome p450 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0009 0.0837 0.5
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0045 0.6944 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium falciparum ubiquitin specific protease, putative 0.0004 0.0002 0.5
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0009 0.0837 0.1204
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0009 0.0837 0.5
Toxoplasma gondii cytochrome p450 superfamily protein 0.0009 0.0837 0.0942
Trichomonas vaginalis ubiquitin specific protease, putative 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis cpg binding protein 0.0031 0.4678 0.6358
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.092 0.1248
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.7357 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0009 0.0837 0.5
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0009 0.0837 0.5
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0009 0.0837 0.5
Trypanosoma cruzi cytochrome P450, putative 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Loa Loa (eye worm) cytochrome P450 family protein 0.0032 0.4734 0.6433
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0009 0.0837 0.5
Plasmodium vivax hypothetical protein, conserved 0.0004 0.0002 0.5
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0009 0.0837 0.5
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0009 0.0837 0.5
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0634 0.0633
Trichomonas vaginalis Harbinger-1_Harbinger/PIFA2 transposable element protein 0.0004 0.0002 0.0003
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0634 0.086
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0045 0.6944 1
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Onchocerca volvulus 0.003 0.4393 1
Echinococcus granulosus cpg binding protein 0.0031 0.4678 0.6358
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0009 0.0837 0.1204
Trypanosoma cruzi cytochrome P450, putative 0.0009 0.0837 0.1204
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.7357 0.7357
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0634 0.086
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0009 0.0837 0.5
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase 2, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Harbinger-1_Harbinger/PIFA2 transposable element protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Loa Loa (eye worm) hypothetical protein 0.0045 0.6944 0.9437
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0009 0.0837 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.7357 1
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax ubiquitin specific protease, putative 0.0004 0.0002 0.5
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0045 0.6944 0.6943
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0045 0.6944 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.6944 1
Trichomonas vaginalis Harbinger-1_Harbinger/PIFA2 transposable element protein 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Harbinger-1_Harbinger/PIFA2 transposable element protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0009 0.0837 0.5
Mycobacterium leprae Conserved hypothetical protein 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0634 0.086
Brugia malayi Cytochrome P450 family protein 0.0032 0.4734 0.6433
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.6944 1
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.8867 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus granulosus ubiquitin specific protease 41 0.0045 0.6944 0.9437
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis helicase, putative 0.0007 0.0525 0.0756
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Schistosoma mansoni cpg binding protein 0.0031 0.4678 0.4677
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0045 0.6944 0.9437
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Loa Loa (eye worm) cytochrome P450 0.0009 0.0837 0.1136
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0009 0.0837 0.5
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase 13, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0045 0.6944 0.9437
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0939 0.1274
Schistosoma mansoni cpg binding protein 0.003 0.4393 0.4392
Leishmania major cytochrome p450-like protein 0.0009 0.0837 0.1204
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0045 0.6944 0.9437
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.6944 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.7357 1
Brugia malayi cytochrome P450 0.0009 0.0837 0.1136
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.6944 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trypanosoma brucei cytochrome P450, putative 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase 1, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0009 0.0837 0.5
Loa Loa (eye worm) CYP4Cod1 0.0009 0.0837 0.1136
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Brugia malayi Cytochrome P450 family protein 0.0009 0.0837 0.1136
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Schistosoma mansoni hypothetical protein 0.0009 0.0837 0.0836
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0009 0.0837 0.5
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase 13, putative 0.0004 0.0002 0.5
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0939 0.1274
Leishmania major cytochrome p450-like protein 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0525 0.0756
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.7357 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Loa Loa (eye worm) cytochrome P450 family protein 0.0009 0.0837 0.1136
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0939 0.1274
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0009 0.0837 0.5
Brugia malayi Cytochrome P450 family protein 0.0009 0.0837 0.1136
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium vivax U4/U6.U5 tri-snRNP-associated protein 2, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium falciparum U4/U6.U5 tri-snRNP-associated protein 2, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0009 0.0837 0.1204
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.7357 0.7357
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0009 0.0837 0.5
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0634 0.086
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.6944 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.7357 1
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase family 2, putative 0.0004 0.0002 0.5
Echinococcus multilocularis 0.0009 0.0837 0.1136
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.6944 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0009 0.0837 0.5
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0009 0.0837 0.5
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0009 0.0837 0.5
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0045 0.6944 0.9437
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase 14 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0009 0.0837 0.5
Leishmania major cytochrome p450-like protein 0.0009 0.0837 0.1204
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Echinococcus multilocularis ubiquitin specific protease 41 0.0045 0.6944 0.9437
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Schistosoma mansoni cpg binding protein 0.0031 0.4678 0.4677
Trichomonas vaginalis ubiquitin specific protease, putative 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Plasmodium falciparum ubiquitin specific protease, putative 0.0004 0.0002 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Brugia malayi CXXC zinc finger family protein 0.003 0.4393 0.597
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0004 0.0109 0.0107
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.4393 0.597
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0009 0.0837 0.5
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0525 0.0756
Loa Loa (eye worm) cytochrome P450 family protein 0.0009 0.0837 0.1136
Brugia malayi Cytochrome P450 family protein 0.0009 0.0837 0.1136
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Schistosoma mansoni cytochrome P450 0.0009 0.0837 0.0836
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0525 0.0756
Trichomonas vaginalis ubiquitin specific protease, putative 0.0004 0.0002 0.0003
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0009 0.0837 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0525 0.0756
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0003
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0004 0.0002 0.0003

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 0.316227766 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 5.011872336 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 25.11886432 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 25.11886432 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
Potency (ADMET) = 0.3162 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2C19. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a. (Class of assay: confirmatory) ChEMBL. No reference
Potency (ADMET) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (ADMET) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (ADMET) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2C9. (Class of assay: confirmatory) [Related pubchem assays: 885, 884, 410 ] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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