Detailed information for compound 1934961

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 540.558 | Formula: C29H32O10
  • H donors: 0 H acceptors: 1 LogP: 4.87 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1cc(OC)c2c(c1)O[C@@H]([C@@H](C2)OC(=O)c1ccc(c(c1)OC)OC)c1cc(OC)c(c(c1)OC)OC
  • InChi: 1S/C29H32O10/c1-31-18-13-21(33-3)19-15-26(39-29(30)16-8-9-20(32-2)23(10-16)34-4)27(38-22(19)14-18)17-11-24(35-5)28(37-7)25(12-17)36-6/h8-14,26-27H,15H2,1-7H3/t26-,27-/m1/s1
  • InChiKey: RUBDMCSYCHRMPQ-KAYWLYCHSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATP-binding cassette, sub-family B (MDR/TAP), member 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 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
Entamoeba histolytica P-glycoprotein-1 Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania donovani 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
Loa Loa (eye worm) hypothetical protein 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
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
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 multidrug resistance protein 1 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 ABC transporter, half transporter, putative 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
Echinococcus multilocularis multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 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
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
Echinococcus multilocularis multidrug resistance protein 1 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
Trichomonas vaginalis multidrug resistance protein 1, 2, putative Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glycoprotein-5 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
Entamoeba histolytica P-glycoprotein-2 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
Brugia malayi ABC transporter family protein Get druggable targets OG5_126596 All targets in OG5_126596
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 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
Plasmodium yoelii multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
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
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative Get druggable targets OG5_126596 All targets in OG5_126596
Brugia malayi multidrug resistance protein 3 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
Trichomonas vaginalis ABC transporter, putative 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
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
Loa Loa (eye worm) hypothetical 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
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 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 ATP-binding cassette transporter, 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
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 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
Leishmania major 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
Trichomonas vaginalis multidrug resistance protein 1, 2, 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
Loa Loa (eye worm) multidrug resistance protein 3 Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma japonicum Multidrug resistance protein 2, 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
Plasmodium falciparum 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
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 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
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
Schistosoma mansoni multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Entamoeba histolytica P-glycoprotein 5, 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
Leishmania mexicana p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis abcb9, putative 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
Echinococcus granulosus multidrug resistance protein 1 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
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, 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
Leishmania donovani p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
Trichomonas vaginalis abcb9, putative Get druggable targets OG5_126596 All targets in OG5_126596
Onchocerca volvulus 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
Trichomonas vaginalis ATP-binding cassette 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
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) Get druggable targets OG5_126596 All targets in OG5_126596
Leishmania infantum ATP-binding cassette protein subfamily B, member 2, putative 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
Trichomonas vaginalis ATP-binding cassette transporter, 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
Chlamydia trachomatis ABC transporter ATP binding protein/permease 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 Multidrug resistance protein 3, 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
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 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
Schistosoma mansoni multidrug resistance protein Get druggable targets OG5_126596 All targets in OG5_126596
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein Get druggable targets OG5_126596 All targets in OG5_126596
Echinococcus multilocularis ATP binding cassette sub family B 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
Echinococcus granulosus multidrug resistance protein 1 Get druggable targets OG5_126596 All targets in OG5_126596
Neospora caninum hypothetical protein 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
Schistosoma mansoni multidrug resistance protein 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
Schistosoma japonicum Multidrug resistance protein 3, putative 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
Trichomonas vaginalis taga, putative Get druggable targets OG5_126596 All targets in OG5_126596
Schistosoma mansoni smdr2 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
Leishmania infantum p-glycoprotein Get druggable targets OG5_126596 All targets in OG5_126596
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus aminopeptidase N 0.0722 1 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0054 0.0054
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0722 1 1
Toxoplasma gondii aminopeptidase n, putative 0.0254 0.3435 1
Trichomonas vaginalis abcb9, putative 0.0013 0.0054 0.0054
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0254 0.3435 0.3435
Loa Loa (eye worm) hypothetical protein 0.0468 0.644 0.6422
Echinococcus multilocularis ATP binding cassette sub family B 0.0013 0.0052 0.0052
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0254 0.3435 0.3401
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0722 1 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0722 1 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0054 0.0054
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0254 0.3435 0.3435
Loa Loa (eye worm) hypothetical protein 0.0254 0.3435 0.3401
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0254 0.3435 0.3435
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0054 0.0054
Brugia malayi Peptidase family M1 containing protein 0.0254 0.3435 0.3399
Loa Loa (eye worm) hypothetical protein 0.0254 0.3435 0.3401
Onchocerca volvulus 0.0722 1 1
Trichomonas vaginalis abcb9, putative 0.0013 0.0054 0.0054
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0013 0.0054 0.0002
Trichomonas vaginalis abcb9, putative 0.0013 0.0054 0.0054
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Echinococcus multilocularis aminopeptidase N 0.0722 1 1
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0722 1 1
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0254 0.3435 1
Loa Loa (eye worm) multidrug resistance protein 3 0.0013 0.0054 0.0002
Echinococcus multilocularis multidrug resistance protein 1 0.0013 0.0054 0.0054
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0722 1 1
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0254 0.3435 0.3399
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0468 0.644 0.644
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0013 0.0054 0.0002
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0722 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0054 0.0054
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0468 0.644 0.4578
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0254 0.3435 0.3401
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0013 0.0054 0.5
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) TATA binding protein associated factor 0.0254 0.3435 0.3401
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0468 0.644 0.6421
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0054 0.0054
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0013 0.0052 0.0052
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0468 0.644 0.6422
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0054 0.0054
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0722 1 1
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0054 0.0054
Echinococcus multilocularis multidrug resistance protein 1 0.0013 0.0054 0.0054
Mycobacterium ulcerans aminopeptidase N PepN 0.0722 1 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0722 1 1
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0254 0.3435 0.3399
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0054 0.0054
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0054 0.0054
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0013 0.0054 0.0054
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0722 1 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0722 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0054 0.0054
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0722 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0054 0.0054
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0254 0.3435 0.3399
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Trypanosoma cruzi aminopeptidase, putative 0.0722 1 1
Trichomonas vaginalis taga, putative 0.0013 0.0054 0.0054
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0722 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Brugia malayi TATA binding protein associated factor 0.0254 0.3435 0.3399
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0013 0.0054 0.5
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0722 1 1
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0722 1 1
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0254 0.3435 0.3399
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Brugia malayi hypothetical protein 0.0254 0.3435 0.3399
Trypanosoma brucei Aminopeptidase M1, putative 0.0722 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0722 1 1
Toxoplasma gondii aminopeptidase N protein 0.0254 0.3435 1
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0722 1 1
Trypanosoma cruzi Aminopeptidase M1, putative 0.0722 1 1
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0722 1 1
Loa Loa (eye worm) hypothetical protein 0.0468 0.644 0.6422
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0722 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0254 0.3435 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0013 0.0054 0.0002
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0254 0.3435 1
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0254 0.3435 0.3435
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0254 0.3435 1
Toxoplasma gondii aminopeptidase N, putative 0.0254 0.3435 1
Trypanosoma brucei Aminopeptidase M1, putative 0.0722 1 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0054 0.0054
Trichomonas vaginalis ABC transporter, putative 0.0013 0.0054 0.0054
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0013 0.0054 0.0054
Brugia malayi hypothetical protein 0.0722 1 1
Entamoeba histolytica aminopeptidase, putative 0.0722 1 1
Loa Loa (eye worm) peptidase family M1 containing protein 0.0254 0.3435 0.3401
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0054 0.0054
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Echinococcus granulosus leukotriene A 4 hydrolase 0.0254 0.3435 0.3435
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0013 0.0054 0.0054
Schistosoma mansoni aminopeptidase A (M01 family) 0.0254 0.3435 0.3399
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0054 0.0054
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0054 0.0054
Onchocerca volvulus 0.0254 0.3435 0.3399
Brugia malayi Peptidase family M1 containing protein 0.0722 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0054 0.0054
Echinococcus granulosus multidrug resistance protein 1 0.0013 0.0054 0.0054
Loa Loa (eye worm) aminopeptidase N 0.0722 1 1
Onchocerca volvulus 0.0722 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 19.5 nM Modulation of P-gp (unknown origin) transfected in human MDA435/LCC6MDR cells assessed as reversible of paclitaxel resistance measured as IC50 for paclitaxel at 1 uM after 5 days by CellTiter 96 Aqueous assay ChEMBL. 25985195
IC50 (ADMET) > 100 uM Cytotoxicity against mouse L929 cells after 3 days by MTS assay ChEMBL. 25985195
Ratio (binding) = 7.4 Modulation of P-gp (unknown origin) transfected in human MDA435/LCC6MDR cells assessed as reversible of paclitaxel resistance measured as IC50 for paclitaxel at 1 uM after 5 days by CellTiter 96 Aqueous assay relative to PTX alone treated cell ChEMBL. 25985195

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

1 literature reference was collected for this gene.

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