Detailed information for compound 1428540

Basic information

Technical information
  • TDR Targets ID: 1428540
  • Name: N-(2,5-dimethylphenyl)-6-morpholin-4-yl-[1,2, 5]oxadiazolo[3,4-e]pyrazin-5-amine
  • MW: 326.353 | Formula: C16H18N6O2
  • H donors: 1 H acceptors: 4 LogP: 2.39 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1Nc1nc2nonc2nc1N1CCOCC1)C
  • InChi: 1S/C16H18N6O2/c1-10-3-4-11(2)12(9-10)17-15-16(22-5-7-23-8-6-22)19-14-13(18-15)20-24-21-14/h3-4,9H,5-8H2,1-2H3,(H,17,18,20)
  • InChiKey: SRSCRCGZMXFGJT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2,5-dimethylphenyl)-6-morpholino-[1,2,5]oxadiazolo[3,4-e]pyrazin-5-amine
  • (2,5-dimethylphenyl)-(6-morpholinofurazano[3,4-e]pyrazin-5-yl)amine
  • N-(2,5-dimethylphenyl)-6-(4-morpholinyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
  • SMR000186717
  • Oprea1_476910
  • ZINC00432142
  • MLS000579129

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cytochrome P450, family 1, subfamily A, polypeptide 2 Starlite/ChEMBL No references
Homo sapiens RAN, member RAS oncogene family No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 9 Starlite/ChEMBL No references
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens snurportin 1 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi GTP-binding nuclear protein rtb2, 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
Entamoeba histolytica hypothetical protein 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
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania mexicana importin beta-1 subunit, 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
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Entamoeba histolytica Ran family GTPase 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
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 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
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Toxoplasma gondii HEAT repeat-containing 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
Trypanosoma brucei 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
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania donovani GTP-binding protein, 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
Trypanosoma brucei importin beta-1 subunit, 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
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum Importin subunit beta-1, putative 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 yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax importin-beta 2, putative 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
Babesia bovis importin beta subunit, 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 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
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
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
Plasmodium berghei importin beta, 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
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania major GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva GTP-binding nuclear protein ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium hominis GTP-binding nuclear protein ran/tc4 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
Leishmania braziliensis GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii 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
Echinococcus multilocularis importin subunit beta 1 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Cytochrome P450 family protein cytochrome P450, family 1, subfamily A, polypeptide 2 516 aa 470 aa 26.2 %
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 cytochrome P450, family 2, subfamily C, polypeptide 9 490 aa 441 aa 21.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.003 0.0139 0.0139
Leishmania major hypothetical protein, conserved 0.003 0.0139 0.0243
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0139 0.0243
Mycobacterium ulcerans hypothetical protein 0.0043 0.0516 0.0221
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.0224 0.572 1
Leishmania major hypothetical protein, conserved 0.0043 0.0516 0.0902
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0516 0.0516
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0516 0.0516
Schistosoma mansoni amidase 0.0327 0.87 0.87
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0516 0.0171
Brugia malayi Amidase family protein 0.0039 0.0398 0.0458
Brugia malayi putative amidase 0.0039 0.0398 0.0458
Schistosoma mansoni fatty-acid amide hydrolase 0.0327 0.87 0.87
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0 0.5
Mycobacterium ulcerans hypothetical protein 0.0224 0.572 1
Mycobacterium ulcerans lipase LipD 0.0043 0.0516 0.0221
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0224 0.572 1
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0516 0.0171
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0075 0.0132
Mycobacterium tuberculosis Conserved protein 0.0043 0.0516 0.0171
Mycobacterium ulcerans lysophospholipase 0.0224 0.572 1
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0139 0.0243
Onchocerca volvulus 0.0043 0.0516 0.5
Brugia malayi Cytochrome P450 family protein 0.0032 0.0172 0.0198
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0516 0.0516
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0516 0.0902
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.572 1
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0516 0.0221
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0075 0.0132
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0516 0.0902
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0075 0.0132
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0516 0.0516
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0516 0.0593
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.572 1
Trichomonas vaginalis conserved hypothetical protein 0.0224 0.572 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0516 0.0902
Leishmania major importin beta-1 subunit, putative 0.0028 0.0075 0.0132
Plasmodium vivax PST-A protein 0.0224 0.572 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0516 0.0902
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0039 0.0398 0.0398
Plasmodium falciparum lysophospholipase, putative 0.0224 0.572 1
Loa Loa (eye worm) amidase 0.0039 0.0398 0.0398
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0139 0.0243
Leishmania major monoglyceride lipase, putative 0.0224 0.572 1
Loa Loa (eye worm) amidase 0.0039 0.0398 0.0398
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0039 0.0398 0.0398
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0516 0.0171
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0266 0.515
Brugia malayi beta-lactamase family protein 0.0043 0.0516 0.0593
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.572 1
Echinococcus granulosus importin subunit beta 1 0.0035 0.0266 0.0266
Loa Loa (eye worm) hypothetical protein 0.0035 0.0266 0.0266
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0039 0.0398 0.0696
Brugia malayi hypothetical protein 0.003 0.0139 0.016
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0266 0.0464
Brugia malayi Amidase family protein 0.0039 0.0398 0.0458
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.7286 1
Trypanosoma brucei monoglyceride lipase, putative 0.0224 0.572 1
Brugia malayi beta-lactamase 0.0043 0.0516 0.0593
Onchocerca volvulus 0.0043 0.0516 0.5
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0039 0.0398 0.5
Trypanosoma cruzi amidase, putative 0.0039 0.0398 0.0696
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0516 0.0902
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0139 0.0243
Brugia malayi Importin beta-1 subunit 0.0035 0.0266 0.0305
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Leishmania major hypothetical protein, conserved 0.0039 0.0398 0.0696
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Brugia malayi RNA, U transporter 1 0.0099 0.2121 0.2437
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0039 0.0398 0.5
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0516 0.0902
Trypanosoma brucei monoglyceride lipase, putative 0.0224 0.572 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0516 0.0221
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0224 0.572 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.572 1
Loa Loa (eye worm) hypothetical protein 0.0327 0.87 0.87
Plasmodium falciparum esterase, putative 0.0224 0.572 1
Schistosoma mansoni importin beta-1 0.0035 0.0266 0.0266
Echinococcus granulosus fatty acid amide hydrolase 1 0.0039 0.0398 0.0398
Echinococcus multilocularis snurportin 1 0.0372 1 1
Mycobacterium ulcerans beta-lactamase 0.0043 0.0516 0.0221
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0039 0.0398 0.5
Schistosoma mansoni fatty-acid amide hydrolase 0.0039 0.0398 0.0398
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0516 0.0171
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0516 0.0171
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Loa Loa (eye worm) hypothetical protein 0.0043 0.0516 0.0516
Echinococcus granulosus fatty acid amide hydrolase 1 0.0327 0.87 0.87
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0516 0.0171
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0327 0.87 0.87
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 1 1
Loa Loa (eye worm) beta-lactamase 0.0043 0.0516 0.0516
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0266 0.0266
Onchocerca volvulus 0.0043 0.0516 0.5
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0039 0.0398 0.0696
Plasmodium vivax importin-beta 2, putative 0.0035 0.0266 0.0464
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0075 0.0132
Trichomonas vaginalis conserved hypothetical protein 0.0224 0.572 1
Plasmodium falciparum importin beta, putative 0.0035 0.0266 0.0464
Echinococcus granulosus fatty acid amide hydrolase 1 0.0327 0.87 0.87
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0516 0.0221
Trypanosoma cruzi amidase, putative 0.0039 0.0398 0.0696
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0139 0.0243
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0516 0.0902
Mycobacterium leprae Probable lipase LipE 0.0043 0.0516 0.0221
Schistosoma mansoni hypothetical protein 0.0372 1 1
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0516 0.0902
Mycobacterium tuberculosis Conserved protein 0.0043 0.0516 0.0171
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.572 1
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0516 0.0171
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0516 0.0516
Plasmodium falciparum lysophospholipase, putative 0.0224 0.572 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0032 0.0172 0.0172
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0516 0.0902
Plasmodium falciparum lysophospholipase, putative 0.0224 0.572 1
Brugia malayi beta-lactamase family protein 0.0043 0.0516 0.0593
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0039 0.0398 0.0696
Toxoplasma gondii ABC1 family protein 0.0043 0.0516 1
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0139 0.0243
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0039 0.0398 0.0398
Trypanosoma cruzi monoglyceride lipase, putative 0.0224 0.572 1
Entamoeba histolytica hypothetical protein 0.0028 0.0075 0.0132
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0139 0.2695
Mycobacterium tuberculosis Conserved protein 0.0043 0.0516 0.0171
Trichomonas vaginalis esterase, putative 0.0043 0.0516 0.0902
Brugia malayi amidase 0.0327 0.87 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0266 0.0464
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0224 0.572 1
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0039 0.0398 0.0398
Mycobacterium tuberculosis Possible lysophospholipase 0.0224 0.572 0.7726
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0327 0.87 0.87

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-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No 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) = 0.354813389 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) = 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-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
Potency (functional) 0.0586 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) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 4.6109 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) 7.9433 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 56.2341 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (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.
 
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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