Detailed information for compound 997281

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 498.017 | Formula: C26H32ClN5O3
  • H donors: 2 H acceptors: 3 LogP: 4.9 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc2nc(nc(c2cc1OC)Nc1ccc(cc1)Cl)N1CCC(CC1)N1CCCC(C1)O
  • InChi: 1S/C26H32ClN5O3/c1-34-23-14-21-22(15-24(23)35-2)29-26(30-25(21)28-18-7-5-17(27)6-8-18)31-12-9-19(10-13-31)32-11-3-4-20(33)16-32/h5-8,14-15,19-20,33H,3-4,9-13,16H2,1-2H3,(H,28,29,30)
  • InChiKey: AUZUCMHFUOGOFB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus chemokine (C-C motif) receptor 4 Starlite/ChEMBL References
Homo sapiens chemokine (C-C motif) receptor 4 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis growth hormone secretagogue receptor type 1 chemokine (C-C motif) receptor 4 360 aa 316 aa 22.1 %
Echinococcus granulosus pyroglutamylated rfamide peptide receptor chemokine (C-C motif) receptor 4 360 aa 396 aa 21.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis tubulin, putative 0.006 0.1878 0.0287
Echinococcus multilocularis Tubulin beta 2C chain 0.0256 1 1
Echinococcus multilocularis tubulin alpha 3 chain 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0133 0.4885 0.4885
Trichomonas vaginalis tubulin beta-1 chain, putative 0.006 0.1878 0.0287
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.006 0.1878 0.5
Plasmodium vivax delta tubulin, putative 0.006 0.1878 0.1878
Loa Loa (eye worm) alpha-tubulin 0.0195 0.7469 0.7469
Echinococcus multilocularis Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Trypanosoma cruzi epsilon tubulin, putative 0.0139 0.5152 0.5152
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Loa Loa (eye worm) transcription factor SMAD2 0.0115 0.4161 0.4161
Echinococcus multilocularis tubulin delta chain 0.006 0.1878 0.1878
Plasmodium falciparum tubulin gamma chain 0.0139 0.5152 0.5152
Leishmania major beta tubulin 0.0256 1 1
Plasmodium vivax tubulin beta chain, putative 0.0256 1 1
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin alpha chain 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin alpha 3 chain 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0256 1 1
Leishmania major beta tubulin 0.0256 1 1
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Loa Loa (eye worm) tubulin gamma chain 0.0139 0.5152 0.5152
Brugia malayi Cell division protein ftsZ 0.006 0.1878 0.1878
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin epsilon chain 0.0139 0.5152 0.5152
Loa Loa (eye worm) tubulin beta chain 0.0256 1 1
Echinococcus multilocularis peroxisome assembly protein 26 0.0195 0.7469 0.7469
Toxoplasma gondii beta-tubulin, putative 0.0256 1 1
Trichomonas vaginalis conserved hypothetical protein 0.006 0.1878 0.0287
Plasmodium vivax tubulin gamma chain, putative 0.0139 0.5152 0.5152
Leishmania major gamma-tubulin 0.0139 0.5152 0.5152
Schistosoma mansoni patched 1 0.0055 0.1638 0.1638
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0079 0.264 0.1198
Giardia lamblia Gamma tubulin 0.0139 0.5152 0.4031
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Trypanosoma cruzi beta tubulin, putative 0.0256 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0139 0.5152 0.4203
Trypanosoma brucei epsilon tubulin 0.0139 0.5152 0.5152
Plasmodium falciparum tubulin beta chain 0.0256 1 1
Echinococcus granulosus tubulin alpha 1C chain 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin epsilon chain 0.0139 0.5152 0.5152
Trypanosoma brucei epsilon tubulin 0.0139 0.5152 0.5152
Brugia malayi hypothetical protein 0.0146 0.5436 0.5436
Plasmodium falciparum tubulin epsilon chain, putative 0.0139 0.5152 0.5152
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Giardia lamblia Alpha-tubulin 0.0195 0.7469 0.6884
Leishmania major beta tubulin 0.0256 1 1
Schistosoma mansoni alpha tubulin 0.0195 0.7469 0.7469
Echinococcus granulosus Niemann Pick C1 protein 0.0055 0.1638 0.1638
Echinococcus multilocularis Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.1368 0.1368
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.1368 0.1368
Giardia lamblia Alpha-tubulin 0.0195 0.7469 0.6884
Trypanosoma cruzi tubulin delta chain 0.006 0.1878 0.1878
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin alpha chain, putative 0.0079 0.264 0.1198
Echinococcus multilocularis tubulin alpha chain 0.0195 0.7469 0.7469
Toxoplasma gondii beta-1 tubulin, putative 0.0256 1 1
Brugia malayi beta-tubulin, identical 0.0256 1 1
Loa Loa (eye worm) tubulin alpha 2 0.0056 0.1682 0.1682
Echinococcus granulosus geminin 0.0164 0.6173 0.6173
Echinococcus multilocularis Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Schistosoma mansoni alpha tubulin 0.0195 0.7469 0.7469
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0133 0.4885 0.4885
Leishmania major beta tubulin 0.0256 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0139 0.5152 0.5152
Toxoplasma gondii alpha tubulin TUBA1 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.0256 1 1
Trypanosoma brucei alpha tubulin, putative 0.0079 0.264 0.264
Trypanosoma cruzi epsilon tubulin, putative 0.0139 0.5152 0.5152
Leishmania major beta tubulin 0.0256 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.0256 1 1
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Loa Loa (eye worm) tubulin alpha 2 0.0134 0.4957 0.4957
Schistosoma mansoni hypothetical protein 0.0164 0.6173 0.6173
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0062 0.1955 0.0379
Loa Loa (eye worm) beta-tubulin 0.0256 1 1
Schistosoma mansoni hypothetical protein 0.0164 0.6173 0.6173
Mycobacterium leprae cell division protein FtsZ 0.006 0.1878 0.5
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0134 0.4957 0.3969
Entamoeba histolytica tubulin alpha-1 chain 0.0195 0.7469 0.478
Entamoeba histolytica tubulin alpha chain, putative 0.0195 0.7469 0.478
Brugia malayi tubulin alpha-2 chain 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin beta chain, putative 0.0079 0.264 0.1198
Loa Loa (eye worm) tubulin beta-1 chain 0.0256 1 1
Echinococcus granulosus peroxisome assembly protein 26 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin epsilon chain, putative 0.006 0.1878 0.0287
Loa Loa (eye worm) tubulin beta-4 chain 0.0256 1 1
Trypanosoma brucei alpha tubulin 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin alpha chain, putative 0.0139 0.5152 0.4203
Echinococcus multilocularis tubulin beta 1 chain 0.0256 1 1
Brugia malayi Tubulin beta chain 0.006 0.1878 0.1878
Onchocerca volvulus 0.0146 0.5436 1
Schistosoma mansoni hypothetical protein 0.0033 0.0734 0.0734
Schistosoma mansoni tubulin subunit alpha 0.0195 0.7469 0.7469
Schistosoma mansoni tubulin subunit alpha 0.0195 0.7469 0.7469
Leishmania major epsilon tubulin, putative 0.0139 0.5152 0.5152
Echinococcus granulosus tubulin delta chain 0.006 0.1878 0.1878
Echinococcus granulosus Tubulin beta 2C chain 0.0256 1 1
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Echinococcus multilocularis tubulin alpha 1C chain 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin alpha chain 0.0195 0.7469 0.7469
Trypanosoma cruzi zeta tubulin, putative 0.006 0.1878 0.1878
Echinococcus multilocularis Tubulin beta 2C chain 0.0256 1 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0115 0.4161 0.4161
Leishmania major beta tubulin 0.0256 1 1
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Echinococcus granulosus sterol regulatory element binding protein 0.0055 0.1638 0.1638
Echinococcus granulosus tubulin alpha 3 chain 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Trichomonas vaginalis tubulin gamma chain, putative 0.006 0.1878 0.0287
Echinococcus multilocularis tubulin subunit beta 0.0256 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Plasmodium vivax tubulin epsilon chain, putative 0.0139 0.5152 0.5152
Loa Loa (eye worm) tubulin alpha-3 chain 0.0116 0.4195 0.4195
Entamoeba histolytica tubulin family protein 0.0256 1 1
Brugia malayi Tubulin alpha-2 chain 0.0195 0.7469 0.7469
Loa Loa (eye worm) tubulin beta chain 0.006 0.1878 0.1878
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0133 0.4885 0.4885
Leishmania major beta tubulin 0.0256 1 1
Echinococcus multilocularis hypothetical protein 0.0195 0.7469 0.7469
Schistosoma mansoni tubulin subunit delta 0.006 0.1878 0.1878
Trichomonas vaginalis tubulin, putative 0.0079 0.264 0.1198
Leishmania major beta tubulin 0.0256 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0256 1 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0055 0.1638 0.1638
Trypanosoma brucei beta tubulin 0.0139 0.5152 0.5152
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.1368 0.1368
Trichomonas vaginalis tubulin beta chain, putative 0.0195 0.7469 0.6974
Loa Loa (eye worm) hypothetical protein 0.0116 0.4195 0.4195
Echinococcus multilocularis tubulin alpha 0.0139 0.5152 0.5152
Toxoplasma gondii alpha-tubulin I, putative 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin, putative 0.0256 1 1
Echinococcus granulosus alpha tubulin 0.0195 0.7469 0.7469
Schistosoma mansoni tubulin subunit gamma 0.0139 0.5152 0.5152
Trypanosoma cruzi tubulin delta chain 0.006 0.1878 0.1878
Loa Loa (eye worm) alpha-tubulin 0.0195 0.7469 0.7469
Loa Loa (eye worm) hypothetical protein 0.0146 0.5436 0.5436
Plasmodium vivax tubulin alpha chain, putative 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin alpha chain, putative 0.0256 1 1
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0133 0.4885 0.4885
Echinococcus multilocularis beta tubulin 0.0256 1 1
Loa Loa (eye worm) BEN-1 protein 0.0256 1 1
Trypanosoma brucei beta tubulin 0.0256 1 1
Echinococcus multilocularis sterol regulatory element binding protein 0.0055 0.1638 0.1638
Echinococcus granulosus beta tubulin 0.0256 1 1
Trypanosoma brucei zeta tubulin 0.006 0.1878 0.1878
Trypanosoma brucei alpha tubulin 0.0195 0.7469 0.7469
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin alpha chain 0.0195 0.7469 0.7469
Leishmania major delta tubulin, putative 0.006 0.1878 0.1878
Giardia lamblia Beta tubulin 0.0256 1 1
Echinococcus multilocularis protein dispatched 1 0.0055 0.1638 0.1638
Trypanosoma brucei epsilon tubulin 0.0139 0.5152 0.5152
Trichomonas vaginalis tubulin beta chain, putative 0.0256 1 1
Brugia malayi Tubulin alpha-2 chain 0.0195 0.7469 0.7469
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0062 0.1955 0.0379
Leishmania major beta tubulin 0.0256 1 1
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0133 0.4885 1
Brugia malayi Tubulin alpha chain 0.006 0.1878 0.1878
Echinococcus multilocularis tubulin alpha chain 0.0195 0.7469 0.7469
Trypanosoma cruzi alpha tubulin, putative 0.0195 0.7469 0.7469
Brugia malayi Tubulin alpha chain 0.0195 0.7469 0.7469
Echinococcus multilocularis tubulin alpha chain 0.0195 0.7469 0.7469
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0134 0.4957 0.4957
Trypanosoma cruzi zeta tubulin, putative 0.006 0.1878 0.1878
Mycobacterium tuberculosis Cell division protein FtsZ 0.006 0.1878 1
Echinococcus granulosus tubulin alpha chain 0.0195 0.7469 0.7469
Echinococcus granulosus Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Leishmania major beta tubulin 0.0256 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.006 0.1878 0.1878
Loa Loa (eye worm) hypothetical protein 0.0195 0.7469 0.7469
Trypanosoma brucei beta tubulin 0.0256 1 1
Echinococcus granulosus tubulin alpha 3 chain 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin gamma chain, putative 0.0139 0.5152 0.4203
Loa Loa (eye worm) hypothetical protein 0.0048 0.1368 0.1368
Echinococcus multilocularis beta tubulin 0.0256 1 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0734 0.0734
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Schistosoma mansoni alpha tubulin 0.0195 0.7469 0.7469
Trypanosoma brucei alpha tubulin 0.0195 0.7469 0.7469
Echinococcus multilocularis protein patched 0.0055 0.1638 0.1638
Entamoeba histolytica tubulin family protein 0.0256 1 1
Brugia malayi Tubulin beta chain 0.0079 0.264 0.264
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0133 0.4885 0.4885
Echinococcus granulosus tubulin beta 1 chain 0.0256 1 1
Loa Loa (eye worm) BEN-1 protein 0.0256 1 1
Echinococcus multilocularis geminin 0.0164 0.6173 0.6173
Loa Loa (eye worm) tubulin alpha 2 0.0134 0.4957 0.4957
Echinococcus granulosus beta tubulin 0.0256 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0256 1 1
Schistosoma mansoni tubulin subunit beta 0.0256 1 1
Trypanosoma cruzi tubulin gamma chain 0.0139 0.5152 0.5152
Echinococcus granulosus tubulin alpha 0.0139 0.5152 0.5152
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0055 0.1638 0.1638
Echinococcus granulosus Protein patched homolog 1 0.0055 0.1638 0.1638
Echinococcus multilocularis tubulin gamma 1 chain 0.0139 0.5152 0.5152
Trichomonas vaginalis conserved hypothetical protein 0.006 0.1878 0.0287
Echinococcus multilocularis Tubulin beta 2C chain 0.0256 1 1
Trichomonas vaginalis tubulin, putative 0.0079 0.264 0.1198
Schistosoma mansoni tubulin subunit alpha 0.0195 0.7469 0.7469
Schistosoma mansoni tubulin subunit beta 0.006 0.1878 0.1878
Echinococcus multilocularis tubulin alpha 1C chain 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin alpha chain 0.0195 0.7469 0.7469
Trypanosoma brucei tubulin delta chain 0.006 0.1878 0.1878
Loa Loa (eye worm) tubulin beta-2A chain 0.0256 1 1
Loa Loa (eye worm) hypothetical protein 0.0134 0.4957 0.4957
Schistosoma mansoni tubulin subunit epsilon 0.0139 0.5152 0.5152
Echinococcus multilocularis Tubulin beta 2C chain 0.0256 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0256 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0195 0.7469 0.6974
Trypanosoma brucei alpha tubulin 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin alpha 1C chain 0.0195 0.7469 0.7469
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0734 0.0734
Schistosoma mansoni tubulin subunit alpha 0.006 0.1878 0.1878
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin alpha chain 0.0195 0.7469 0.7469
Trichomonas vaginalis tubulin alpha chain, putative 0.0079 0.264 0.1198
Loa Loa (eye worm) tubulin alpha-2 chain 0.0195 0.7469 0.7469
Echinococcus granulosus Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Brugia malayi MH2 domain containing protein 0.0115 0.4161 0.4161
Plasmodium falciparum alpha tubulin 1 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin gamma 1 chain 0.0139 0.5152 0.5152
Loa Loa (eye worm) tubulin alpha chain 0.0195 0.7469 0.7469
Trypanosoma brucei tubulin gamma chain 0.0139 0.5152 0.5152
Loa Loa (eye worm) hypothetical protein 0.0133 0.4885 0.4885
Brugia malayi tubulin alpha chain - mouse 0.0195 0.7469 0.7469
Loa Loa (eye worm) tubulin alpha chain 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin subunit beta 0.0256 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0195 0.7469 0.7469
Giardia lamblia Beta tubulin 0.0256 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0256 1 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0055 0.1638 0.1638
Loa Loa (eye worm) hypothetical protein 0.0055 0.1638 0.1638
Trypanosoma brucei zeta tubulin, putative 0.006 0.1878 0.1878
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.006 0.1878 0.1878
Trypanosoma brucei beta tubulin 0.0256 1 1
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.0062 0.1955 0.0095
Echinococcus granulosus Tubulin beta 2C chain 0.0256 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0195 0.7469 0.6974
Echinococcus granulosus tubulin subunit TubB 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Giardia lamblia Beta tubulin 0.0256 1 1
Echinococcus multilocularis tubulin subunit TubB 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0133 0.4885 0.4885
Plasmodium falciparum alpha tubulin 2 0.0195 0.7469 0.7469
Leishmania major alpha tubulin 0.0195 0.7469 0.7469
Echinococcus granulosus tubulin beta 4A class IVa 0.0256 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0116 0.4195 0.3058
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0062 0.1955 0.0379
Brugia malayi CHE-14 protein 0.0055 0.1638 0.1638
Brugia malayi alpha-tubulin 0.0195 0.7469 0.7469
Treponema pallidum cell division protein FtsZ 0.006 0.1878 0.5
Toxoplasma gondii beta tubulin 0.0256 1 1
Plasmodium falciparum tubulin delta chain, putative 0.006 0.1878 0.1878
Echinococcus granulosus tubulin alpha chain 0.0195 0.7469 0.7469
Leishmania major beta tubulin 0.0256 1 1
Leishmania major zeta tubulin, putative 0.006 0.1878 0.1878
Plasmodium vivax tubulin alpha chain, putative 0.0195 0.7469 0.7469
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0133 0.4885 0.4885
Brugia malayi Tubulin gamma chain 0.0139 0.5152 0.5152
Leishmania major beta tubulin 0.0256 1 1
Leishmania major beta tubulin 0.0256 1 1
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0133 0.4885 0.4885
Trichomonas vaginalis tubulin epsilon chain, putative 0.0195 0.7469 0.6974
Trypanosoma brucei beta tubulin 0.0256 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0079 0.264 0.1198
Echinococcus granulosus Tubulin beta 2C chain 0.0256 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 0.048 uM Antagonist activity at human CCR4 receptor expressed in mouse B300-19 cells assessed as CCL22-induced [35S]GTPgammaS binding ChEMBL. 19081254
IC50 (functional) = 0.085 uM Antagonist activity at human CCR4 receptor expressed in mouse B300-19 cells assessed as CCL22-induced chemotaxis ChEMBL. 19081254
IC50 (functional) = 0.43 uM Antagonist activity at mouse CCR4 receptor expressed in mouse B300-19 cells assessed as CCL22-induced chemotaxis ChEMBL. 19081254

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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