Detailed information for compound 1706301

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 479.53 | Formula: C28H25N5O3
  • H donors: 0 H acceptors: 3 LogP: 4.38 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCN(CC1)c1cc(nc2n1nc(c2)c1ccccc1)c1ccco1)OCc1ccccc1
  • InChi: 1S/C28H25N5O3/c34-28(36-20-21-8-3-1-4-9-21)32-15-13-31(14-16-32)27-19-24(25-12-7-17-35-25)29-26-18-23(30-33(26)27)22-10-5-2-6-11-22/h1-12,17-19H,13-16,20H2
  • InChiKey: TUVZAHBTROQQCR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATP-binding cassette, sub-family B (MDR/TAP), member 1 Starlite/ChEMBL No references
Homo sapiens ATP-binding cassette, sub-family G (WHITE), member 2 (Junior blood group) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans identical to C terminus of nonallelic CaP19.919 Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein Get druggable targets OG5_126574 All targets in OG5_126574
Trypanosoma brucei gambiense ATP-binding cassette protein, putative Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus multilocularis ATP binding cassette sub family B Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum ko:K05659 ATP-binding cassette, subfamily B (MDR/TAP), member 4, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Onchocerca volvulus Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Plasmodium berghei ABC transporter G family member 2, putative Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans similar to N terminus of CaP19.6000 multidrug resistance transporter CDR1 Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma japonicum Multidrug resistance protein 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Loa Loa (eye worm) multidrug resistance protein 3 Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glycoprotein-2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Loa Loa (eye worm) ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans similar to S. cerevisiae PDR5 (YOR153W) Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) Get druggable targets OG5_126574 All targets in OG5_126574
Cryptosporidium parvum ABC transporter, AAA domain Get druggable targets OG5_126574 All targets in OG5_126574
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania major p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Neospora caninum hypothetical protein Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans potential ABC transporter whose deletion does not affect fluconazole resistance Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Cryptosporidium parvum ATP-binding cassette transporter Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania braziliensis ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trypanosoma brucei gambiense ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania mexicana p-glycoprotein-like protein,ABC transporter-like protein,multidrug resistance protein-like protein Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania major ATP-binding cassette protein subfamily G, member 4, putative Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans potential ABC transporter similar to S. cerevisiae STE6 (YKL209C) involved in peptide pheromone export Get druggable targets OG5_126596 All targets in OG5_126596
Trypanosoma brucei ATP-binding cassette protein, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans potential ABC family transporter similar to S. cerevisiae YNR070W Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Chlamydia trachomatis ABC transporter ATP binding protein/permease Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania major ATP-binding cassette protein subfamily G, member 6, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans multidrug resistance ABC transporter similar to S. cerevisiae PDR5 (YOR153W) Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ATP-binding cassette transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium vivax multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania donovani ATP-binding cassette protein subfamily G, member 4, putative Get druggable targets OG5_126574 All targets in OG5_126574
Entamoeba histolytica P-glycoprotein 5, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania infantum p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ABC transporter, half transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Toxoplasma gondii ATP-binding cassette G family transporter ABCG84 Get druggable targets OG5_126574 All targets in OG5_126574
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania donovani ATP-binding cassette protein subfamily B, member 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Multidrug resistance protein 3, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Neospora caninum ATP-binding cassette, sub-family B (MDR/TAP), member 4, related Get druggable targets OG5_126596 All targets in OG5_126596
Cryptosporidium hominis ATP-binding cassette protein 3 Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium yoelii multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania braziliensis p-glycoprotein-like protein,ABC transporter-like protein,multidrug resistance protein-like protein Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium vivax ABC transporter G family member 2, putative Get druggable targets OG5_126574 All targets in OG5_126574
Entamoeba histolytica P-glycoprotein-2 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum ATP-binding cassette sub-family B member 5, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans N terminal 2/3 of Opaque-specific ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Plasmodium knowlesi ABC transporter G family member 2, putative Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma mansoni multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Brugia malayi ABC transporter family protein Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis taga, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis abcb9, putative Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glycoprotein-2 Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma mansoni hypothetical protein Get druggable targets OG5_126574 All targets in OG5_126574
Brugia malayi ABC transporter family protein Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium berghei multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans similar to N terminus of CaP19.6000 multidrug resistance transporter CDR1 Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans potential ABC transporter similar to S. cerevisiae YOL075C Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein Get druggable targets OG5_126574 All targets in OG5_126574
Trypanosoma cruzi ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania braziliensis ATP-binding cassette protein, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ABC transporter, half transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glycoprotein-1 Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum ATP-binding cassette sub-family G member 1, putative Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans multidrug resistance protein CDR1 originally isolated by ability to functionally substitute for S. cerevisiae PDR5 (YOR153W) ABC Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ABC transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Bile salt export pump, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans potential ABC transporter similar to S. cerevisiae YOL075C Get druggable targets OG5_126574 All targets in OG5_126574
Cryptosporidium hominis ABC transporter protein Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus granulosus ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma japonicum Multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Neospora caninum hypothetical protein Get druggable targets OG5_126574 All targets in OG5_126574
Giardia lamblia ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Brugia malayi multidrug resistance protein 3 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans potential ABC family transporter similar to S. cerevisiae YNR070W Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans multidrug resistance protein CDR1 originally isolated by ability to functionally substitute for S. cerevisiae PDR5 (YOR153W) ABC Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis abcb9, putative Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium knowlesi multidrug resistance protein 1, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trypanosoma cruzi ATP-binding cassette protein, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ABC transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans multidrug resistance ABC transporter similar to S. cerevisiae PDR5 (YOR153W) Get druggable targets OG5_126574 All targets in OG5_126574
Trypanosoma congolense ATP-binding cassette protein, putative Get druggable targets OG5_126574 All targets in OG5_126574
Entamoeba histolytica P-glycoprotein-5 Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania mexicana ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma japonicum Multidrug resistance protein 3, putative Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania mexicana p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma mansoni ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania infantum ATP-binding cassette protein subfamily G, member 4, putative Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma japonicum ko:K05681 ATP-binding cassette, subfamily G (WHITE), member 2, putative Get druggable targets OG5_126574 All targets in OG5_126574
Plasmodium falciparum multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP Get druggable targets OG5_126596 All targets in OG5_126596
Trypanosoma congolense ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
Trichomonas vaginalis ABC transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania donovani p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans identical to C terminus of nonallelic CaP19.919 Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans potential ABC transporter whose deletion does not affect fluconazole resistance Get druggable targets OG5_126574 All targets in OG5_126574
Leishmania infantum ATP-binding cassette protein subfamily B, member 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Candida albicans similar to S. cerevisiae PDR5 (YOR153W) Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma mansoni multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Mycobacterium tuberculosis Probable conserved transmembrane ATP-binding protein ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Candida albicans N terminal 2/3 of Opaque-specific ABC transporter Get druggable targets OG5_126574 All targets in OG5_126574
Schistosoma mansoni multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma mansoni smdr2 Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis ABC transporter, putative Get druggable targets OG5_126596 All targets in OG5_126596
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis abcb9, putative Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glyco protein 6, putative Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus ATP binding cassette sub family G Get druggable targets OG5_126574 All targets in OG5_126574
Echinococcus granulosus 5'partial|ATP binding cassette sub family B Get druggable targets OG5_126596 All targets in OG5_126596
Plasmodium falciparum ABC transporter G family member 2 Get druggable targets OG5_126574 All targets in OG5_126574
Trypanosoma brucei ABC transporter, putative Get druggable targets OG5_126574 All targets in OG5_126574
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei ABC transporter, putative ATP-binding cassette, sub-family G (WHITE), member 2 (Junior blood group) 611 aa 557 aa 28.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0013 0.0593 0.2023
Entamoeba histolytica P-glycoprotein-2, putative 0.0013 0.0593 1
Brugia malayi Thioredoxin reductase 0.0047 0.2932 1
Trichomonas vaginalis taga, putative 0.0013 0.0593 0.7215
Echinococcus granulosus ATP binding cassette sub family G 0.0012 0.0535 0.1823
Echinococcus granulosus multidrug resistance protein 1 0.0009 0.0327 0.1116
Echinococcus multilocularis multidrug resistance protein 1 0.0013 0.0593 0.2023
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0822 0.2803
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0118 0.789 1
Schistosoma mansoni hypothetical protein 0.001 0.039 0.039
Plasmodium vivax thioredoxin reductase, putative 0.0047 0.2932 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0593 0.2023
Trichomonas vaginalis abcb9, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0593 0.7215
Loa Loa (eye worm) glutathione reductase 0.0047 0.2932 1
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0525 0.179
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.0822 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.2826 0.9641
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0047 0.2932 0.3716
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0016 0.0822 0.2803
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0012 0.0535 0.6504
Entamoeba histolytica P-glycoprotein-2 0.0013 0.0593 1
Entamoeba histolytica P-glyco protein 6, putative 0.0013 0.0593 1
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0016 0.0822 0.2803
Brugia malayi ABC transporter family protein 0.0013 0.0593 0.2023
Echinococcus multilocularis thioredoxin glutathione reductase 0.0047 0.2932 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Plasmodium vivax glutathione reductase, putative 0.0047 0.2932 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0107 0.7068 0.8958
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0016 0.0822 1
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0593 0.7215
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0016 0.0822 0.2803
Echinococcus granulosus ATP binding cassette sub family G 0.0012 0.0535 0.1823
Brugia malayi multidrug resistance protein 3 0.0013 0.0593 0.2023
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0013 0.0593 0.2023
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0593 0.2023
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0016 0.0822 0.2803
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0013 0.0574 0.1957
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0118 0.789 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0593 0.2023
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0593 0.2023
Schistosoma mansoni ABC transporter 0.001 0.041 0.041
Mycobacterium tuberculosis Probable oxidoreductase 0.0118 0.789 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0593 0.2023
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2826 0.2826
Echinococcus multilocularis ATP binding cassette sub family G 0.0012 0.0535 0.1823
Echinococcus multilocularis multidrug resistance protein 1 0.0009 0.0327 0.1116
Leishmania major ATP-binding cassette protein subfamily G, member 4, putative 0.0012 0.0535 0.1823
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0016 0.0822 0.2803
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2826 0.2826
Toxoplasma gondii ATP-binding cassette G family transporter ABCG84 0.0012 0.0535 0.1823
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0593 0.7215
Entamoeba histolytica P-glycoprotein-2 0.0013 0.0593 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Brugia malayi glutathione reductase 0.0047 0.2932 1
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0593 0.2023
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0016 0.0822 0.2803
Schistosoma mansoni multidrug resistance protein 0.0013 0.0593 0.0593
Brugia malayi ABC transporter family protein 0.001 0.041 0.1397
Mycobacterium tuberculosis Probable reductase 0.0107 0.7068 0.8958
Trypanosoma brucei ATP-binding cassette protein, putative 0.0012 0.0535 0.1823
Onchocerca volvulus 0.0013 0.0593 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0107 0.7068 0.8958
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Echinococcus granulosus thioredoxin glutathione reductase 0.0047 0.2932 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.2826 0.9641
Loa Loa (eye worm) multidrug resistance protein 3 0.0013 0.0593 0.2023
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0822 0.2803
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0593 0.2023
Trichomonas vaginalis glutathione reductase, putative 0.0016 0.0822 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0016 0.0822 0.2803
Plasmodium falciparum ABC transporter G family member 2 0.0012 0.0535 0.1823
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0013 0.0593 0.2023
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Plasmodium falciparum multidrug resistance protein 1 0.0013 0.0593 0.2023
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0009 0.0327 0.3981
Trypanosoma cruzi trypanothione reductase, putative 0.0047 0.2932 1
Giardia lamblia ABC transporter 0.0012 0.0515 0.627
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0822 0.2803
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0593 0.2023
Trypanosoma cruzi ABC transporter, putative 0.0012 0.0535 0.1823
Trypanosoma brucei trypanothione reductase 0.0047 0.2932 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.2826 0.9641
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.2826 0.9641
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0012 0.0535 0.6504
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Schistosoma mansoni multidrug resistance protein 0.0013 0.0593 0.0593
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0107 0.7068 0.8958
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0016 0.0822 1
Leishmania major p-glycoprotein 0.0013 0.0593 0.2023
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0016 0.0822 0.2803
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0593 0.2023
Loa Loa (eye worm) thioredoxin reductase 0.0047 0.2932 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0593 0.2023
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.0012 0.0535 0.0535
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.2826 0.9641
Toxoplasma gondii thioredoxin reductase 0.0047 0.2932 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0593 0.2023
Echinococcus granulosus ATP binding cassette sub family G 0.0012 0.0535 0.1823
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Entamoeba histolytica P-glycoprotein-1 0.0013 0.0593 1
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0593 0.7215
Loa Loa (eye worm) ABC transporter 0.001 0.041 0.1397
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Treponema pallidum NADH oxidase 0.0016 0.0822 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0012 0.0535 0.6504
Plasmodium falciparum glutathione reductase 0.0016 0.0822 0.2803
Schistosoma mansoni multidrug resistance protein 0.0013 0.0593 0.0593
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Entamoeba histolytica P-glycoprotein-5 0.0013 0.0593 1
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis mercuric reductase, putative 0.0016 0.0822 1
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0013 0.0593 0.7215
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0013 0.0593 0.0752
Trichomonas vaginalis abcb9, putative 0.0013 0.0593 0.7215
Leishmania major ATP-binding cassette protein subfamily G, member 6, putative 0.0012 0.0535 0.1823
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Mycobacterium tuberculosis Probable dehydrogenase 0.0107 0.7068 0.8958
Entamoeba histolytica P-glycoprotein 5, putative 0.0013 0.0593 1
Leishmania major trypanothione reductase 0.0047 0.2932 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0822 0.2803
Loa Loa (eye worm) hypothetical protein 0.0013 0.0593 0.2023
Trichomonas vaginalis abcb9, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Echinococcus multilocularis multidrug resistance protein 1 0.0013 0.0593 0.2023
Plasmodium falciparum thioredoxin reductase 0.0047 0.2932 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0593 0.2023
Echinococcus granulosus multidrug resistance protein 1 0.0009 0.0327 0.1116
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0016 0.0822 0.1042
Toxoplasma gondii NADPH-glutathione reductase 0.0016 0.0822 0.2803
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0822 0.2803
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0593 0.7215
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0593 0.7215
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0593 0.2023
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0593 0.7215
Echinococcus multilocularis ATP binding cassette sub family G 0.0012 0.0535 0.1823
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.2826 0.9641
Loa Loa (eye worm) hypothetical protein 0.0013 0.0574 0.1957
Schistosoma mansoni smdr2 0.0013 0.0593 0.0593
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0016 0.0822 0.2803
Entamoeba histolytica ABC transporter, putative 0.0012 0.0535 0.9014
Plasmodium falciparum thioredoxin reductase 0.0016 0.0822 0.2803
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0016 0.0822 1
Plasmodium vivax ABC transporter G family member 2, putative 0.0012 0.0535 0.1823
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0013 0.0593 0.2023
Echinococcus multilocularis ATP binding cassette sub family B 0.0013 0.0574 0.1957
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0107 0.7068 0.8958
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0525 0.179
Giardia lamblia NADH oxidase lateral transfer candidate 0.0016 0.0822 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0593 0.7215
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0822 1
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0822 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0822 0.0822
Trypanosoma cruzi trypanothione reductase, putative 0.0016 0.0822 0.2803
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2826 0.2826
Mycobacterium tuberculosis Probable conserved transmembrane ATP-binding protein ABC transporter 0.001 0.039 0.0495
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0822 0.2803
Plasmodium vivax multidrug resistance protein 1, putative 0.0013 0.0593 0.2023
Plasmodium falciparum glutathione reductase 0.0047 0.2932 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0118 0.789 1
Trypanosoma brucei ABC transporter, putative 0.0012 0.0535 0.1823
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0822 0.2803
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0822 0.2803
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0107 0.7068 0.8958
Echinococcus multilocularis ATP binding cassette sub family G 0.0012 0.0535 0.1823
Trypanosoma cruzi ATP-binding cassette protein, putative 0.0012 0.0535 0.1823

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) 0.00000273 uM PubChem BioAssay. Dose Response for ABC transporter inhibitors: specifically ABCG2 screen, ABCB1 counter-screen. Follow-up assay.. (Class of assay: confirmatory) ChEMBL. No reference
EC50 (functional) 0.00000303 uM PubChem BioAssay. Dose Response for ABC transporter inhibitors: specifically ABCB1 screen, ABCG2 counter-screen. Follow-up assay.. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.