Detailed information for compound 1656938

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 504.545 | Formula: C26H31F3N4O3
  • H donors: 3 H acceptors: 4 LogP: 2.65 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: Cc1ccnc(c1)[C@]1(O)CC[C@@H](CC1)N[C@H]1CCN(C1)C(=O)CNC(=O)c1cccc(c1)C(F)(F)F
  • InChi: 1S/C26H31F3N4O3/c1-17-7-11-30-22(13-17)25(36)9-5-20(6-10-25)32-21-8-12-33(16-21)23(34)15-31-24(35)18-3-2-4-19(14-18)26(27,28)29/h2-4,7,11,13-14,20-21,32,36H,5-6,8-10,12,15-16H2,1H3,(H,31,35)/t20-,21-,25-/m0/s1
  • InChiKey: GVEGSWDMUUWHFN-WATLYSKOSA-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 chemokine (C-C motif) receptor 2 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
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.0035 0.0059
Echinococcus granulosus Tubulin beta 2C chain 0.0144 0.0492 0.3223
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0109 0.0357 0.2303
Trichomonas vaginalis tubulin, putative 0.0081 0.025 0.2427
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0186 0.0655 0.6684
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.0035 0.0059
Echinococcus multilocularis cpg binding protein 0.003 0.005 0.0047
Trichomonas vaginalis tubulin, putative 0.0062 0.0177 0.1655
Trichomonas vaginalis tubulin alpha chain, putative 0.0144 0.0492 0.4971
Loa Loa (eye worm) hypothetical protein 0.0089 0.028 0.2346
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0028 0.0032
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Schistosoma mansoni tyrosinase precursor 0.0089 0.028 0.1776
Loa Loa (eye worm) hypothetical protein 0.0037 0.0079 0.0599
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0298 0.1091 0.402
Trichomonas vaginalis tubulin alpha chain, putative 0.0144 0.0492 0.4971
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0107 0.0351 0.3485
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0144 0.0492 0.0719
Trichomonas vaginalis tubulin alpha chain, putative 0.0081 0.025 0.2427
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0028 0.009
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0042 0.0099 0.4487
Toxoplasma gondii beta-tubulin, putative 0.0144 0.0492 0.1774
Schistosoma mansoni hypothetical protein 0.0049 0.0126 0.0726
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.028 0.0386
Entamoeba histolytica tubulin alpha-1 chain 0.0267 0.097 1
Loa Loa (eye worm) tubulin alpha 2 0.0204 0.0728 0.624
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.0126 0.0174
Echinococcus multilocularis tubulin alpha 0.0144 0.0492 0.0719
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) hypothetical protein 0.0267 0.097 0.8342
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.0126 0.0162
Entamoeba histolytica hypothetical protein 0.0039 0.0087 0.0709
Trypanosoma cruzi epsilon tubulin, putative 0.0144 0.0492 0.1774
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0046 0.0115 0.0145
Brugia malayi Tubulin alpha-2 chain 0.0267 0.097 0.1338
Mycobacterium ulcerans hypothetical protein 0.0026 0.0035 0.0112
Loa Loa (eye worm) hypothetical protein 0.0107 0.0351 0.2962
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Schistosoma mansoni hypothetical protein 0.0049 0.0126 0.0726
Schistosoma mansoni transient receptor potential channel 0.0066 0.0191 0.1167
Echinococcus granulosus tubulin subunit TubB 0.0267 0.097 0.6482
Brugia malayi CHE-14 protein 0.0046 0.0114 0.0157
Echinococcus multilocularis tubulin delta chain 0.0062 0.0177 0.024
Plasmodium falciparum telomerase reverse transcriptase 0.0708 0.2684 1
Trichomonas vaginalis tubulin, putative 0.0081 0.025 0.2427
Toxoplasma gondii histone lysine-specific demethylase 0.0042 0.0099 0.0297
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0062 0.0177 0.5
Mycobacterium ulcerans dehydrogenase 0.0042 0.0099 0.0395
Schistosoma mansoni tubulin subunit alpha 0.0267 0.097 0.6482
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0708 0.2684 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0145 0.0496 0.3251
Echinococcus granulosus GPCR family 2 0.0049 0.0126 0.0726
Echinococcus multilocularis tubulin subunit TubB 0.0267 0.097 0.1447
Echinococcus multilocularis epidermal growth factor receptor 0.0145 0.0499 0.0729
Schistosoma mansoni tubulin subunit delta 0.0062 0.0177 0.1073
Echinococcus multilocularis geminin 0.0167 0.0584 0.0858
Trichomonas vaginalis tubulin beta chain, putative 0.0081 0.025 0.2427
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0062 0.0177 0.1655
Schistosoma mansoni tubulin subunit gamma 0.0144 0.0492 0.3223
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Trypanosoma brucei beta tubulin 0.0144 0.0492 0.1774
Echinococcus granulosus Tubulin beta 2C chain 0.0144 0.0492 0.3223
Trichomonas vaginalis tubulin beta chain, putative 0.0144 0.0492 0.4971
Trypanosoma cruzi tubulin delta chain 0.0062 0.0177 0.0591
Schistosoma mansoni tyrosine kinase 0.0077 0.0235 0.1467
Brugia malayi Tubulin beta chain 0.0062 0.0177 0.0244
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0099 0.0333
Trypanosoma brucei telomerase reverse transcriptase 0.0708 0.2684 1
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Trichomonas vaginalis tubulin epsilon chain, putative 0.0267 0.097 1
Echinococcus granulosus transient receptor potential ion channel A 0.0096 0.0309 0.1972
Toxoplasma gondii beta-1 tubulin, putative 0.0144 0.0492 0.1774
Loa Loa (eye worm) tubulin beta-2A chain 0.0144 0.0492 0.4189
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0156 0.0539 0.0743
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.0496 0.3251
Loa Loa (eye worm) BEN-1 protein 0.0144 0.0492 0.4189
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0098 0.0293
Schistosoma mansoni hypothetical protein 0.0049 0.0126 0.0726
Schistosoma mansoni transient receptor potential channel 0.01 0.0322 0.206
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0036 0.006
Schistosoma mansoni amine oxidase 0.0042 0.0099 0.054
Entamoeba histolytica tubulin alpha chain, putative 0.0267 0.097 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0267 0.097 1
Echinococcus multilocularis dnaJ subfamily B 0.04 0.1486 0.2232
Plasmodium vivax importin-beta 2, putative 0.003 0.005 0.015
Echinococcus multilocularis sterol regulatory element binding protein 0.0046 0.0114 0.0143
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0156 0.0539 0.4594
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.005 0.0114
Entamoeba histolytica acyl-coA synthetase, putative 0.0026 0.0035 0.0164
Echinococcus multilocularis tubulin alpha chain 0.0267 0.097 0.1447
Brugia malayi Tubulin beta chain 0.0081 0.025 0.0345
Schistosoma mansoni tubulin subunit alpha 0.0062 0.0177 0.1073
Loa Loa (eye worm) hypothetical protein 0.0089 0.028 0.2346
Leishmania major delta tubulin, putative 0.0062 0.0177 0.0591
Echinococcus granulosus transient receptor potential gamma protein 0.01 0.0322 0.206
Loa Loa (eye worm) tubulin beta-4 chain 0.0144 0.0492 0.4189
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus expressed conserved protein 0.0101 0.0326 0.2087
Echinococcus multilocularis Tubulin beta 2C chain 0.0144 0.0492 0.0719
Schistosoma mansoni tubulin subunit alpha 0.0267 0.097 0.6482
Brugia malayi alpha-tubulin 0.0267 0.097 0.1338
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus tubulin alpha chain 0.0267 0.097 0.6482
Echinococcus multilocularis Tubulin alpha 1 chain 0.0267 0.097 0.1447
Echinococcus granulosus snurportin 1 0.0316 0.1161 0.7784
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) hypothetical protein 0.0026 0.0035 0.022
Echinococcus multilocularis Niemann Pick C1 protein 0.0153 0.0529 0.0776
Trypanosoma brucei zeta tubulin, putative 0.0062 0.0177 0.0591
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0026 0.0035 0.0141
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Loa Loa (eye worm) BEN-1 protein 0.0144 0.0492 0.4189
Onchocerca volvulus 0.0081 0.025 0.0216
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.1715 0.659 1
Loa Loa (eye worm) tubulin beta chain 0.0062 0.0177 0.1451
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0036 0.0096
Brugia malayi Telomerase reverse transcriptase 0.1885 0.7251 1
Loa Loa (eye worm) beta-tubulin 0.0144 0.0492 0.4189
Trypanosoma cruzi UDP-galactopyranose mutase 0.0042 0.0099 0.0297
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Entamoeba histolytica tubulin family protein 0.0144 0.0492 0.4971
Trichomonas vaginalis tubulin epsilon chain, putative 0.0144 0.0492 0.4971
Schistosoma mansoni patched 1 0.0046 0.0114 0.064
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.0035 0.0164
Brugia malayi latrophilin 2 splice variant baaae 0.0106 0.0348 0.048
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0145 0.0496 0.0726
Brugia malayi Cell division protein ftsZ 0.0062 0.0177 0.0244
Brugia malayi Tubulin gamma chain 0.0144 0.0492 0.0679
Schistosoma mansoni transient receptor potential channel 0.0066 0.0191 0.1167
Leishmania major mitochondrial DNA polymerase beta 0.0298 0.1091 0.402
Trichomonas vaginalis tubulin epsilon chain, putative 0.0062 0.0177 0.1655
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0204 0.0728 0.624
Echinococcus multilocularis tubulin alpha 3 chain 0.0267 0.097 0.1447
Brugia malayi Calcitonin receptor-like protein seb-1 0.0156 0.0539 0.0743
Onchocerca volvulus 0.0089 0.028 0.0246
Trichomonas vaginalis tubulin, putative 0.0144 0.0492 0.4971
Plasmodium falciparum alpha tubulin 2 0.0267 0.097 0.3591
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0599 0.226 1
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0042 0.0099 0.054
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0166 0.0999
Plasmodium vivax delta tubulin, putative 0.0062 0.0177 0.0625
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0177 0.1655
Plasmodium falciparum protoporphyrinogen oxidase 0.0042 0.0099 0.0333
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.0126 0.1009
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0145 0.0496 0.4225
Brugia malayi Protein kinase domain containing protein 0.0046 0.0115 0.0159
Echinococcus multilocularis transient receptor potential gamma protein 0.01 0.0322 0.046
Trypanosoma brucei beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Plasmodium falciparum tubulin epsilon chain, putative 0.0144 0.0492 0.1804
Loa Loa (eye worm) hypothetical protein 0.0049 0.0126 0.1009
Mycobacterium tuberculosis Conserved hypothetical protein 0.0042 0.0099 0.0445
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0026 0.0035 0.0141
Schistosoma mansoni tubulin subunit epsilon 0.0144 0.0492 0.3223
Echinococcus granulosus short transient receptor potential channel 6 0.0066 0.0191 0.1167
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Brugia malayi Transient-receptor-potential like protein 0.0037 0.0079 0.0109
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0145 0.0496 0.3251
Plasmodium vivax tubulin beta chain, putative 0.0144 0.0492 0.1804
Brugia malayi Furin-like cysteine rich region family protein 0.0145 0.0499 0.0688
Schistosoma mansoni cpg binding protein 0.003 0.005 0.0209
Schistosoma mansoni tar DNA-binding protein 0.0069 0.0205 0.126
Brugia malayi hypothetical protein 0.0039 0.0087 0.012
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.005 0.0114
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0081 0.025 0.2427
Schistosoma mansoni hypothetical protein 0.0044 0.0107 0.0597
Loa Loa (eye worm) ShTK domain-containing protein 0.0089 0.028 0.2346
Loa Loa (eye worm) tubulin alpha-2 chain 0.0267 0.097 0.8342
Echinococcus multilocularis Niemann Pick C1 protein 0.0107 0.0351 0.0504
Loa Loa (eye worm) tubulin alpha 2 0.0204 0.0728 0.624
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0087 0.046
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0141 0.0482 0.1735
Brugia malayi Latrophilin receptor protein 2 0.0049 0.0126 0.0174
Echinococcus granulosus Tubulin beta 2C chain 0.0144 0.0492 0.3223
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Loa Loa (eye worm) RNA binding protein 0.0069 0.0205 0.1689
Loa Loa (eye worm) hypothetical protein 0.01 0.0322 0.2708
Schistosoma mansoni hypothetical protein 0.0106 0.0348 0.2238
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Brugia malayi amine oxidase, flavin-containing family protein 0.0042 0.0099 0.0136
Loa Loa (eye worm) hypothetical protein 0.0026 0.0035 0.022
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0036 0.0096
Mycobacterium ulcerans cell division protein FtsZ 0.0062 0.0177 0.0742
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.0177 0.1655
Giardia lamblia Gamma tubulin 0.0144 0.0492 0.1774
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0098 0.0293
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0042 0.0098 0.0293
Leishmania major zeta tubulin, putative 0.0062 0.0177 0.0591
Trypanosoma brucei beta tubulin 0.0144 0.0492 0.1774
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Trichomonas vaginalis tubulin gamma chain, putative 0.0144 0.0492 0.4971
Echinococcus multilocularis snurportin 1 0.0316 0.1161 0.1737
Schistosoma mansoni tar DNA-binding protein 0.0069 0.0205 0.126
Echinococcus granulosus tubulin delta chain 0.0062 0.0177 0.1073
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Echinococcus granulosus tubulin beta 4A class IVa 0.0144 0.0492 0.3223
Brugia malayi Importin beta-1 subunit 0.003 0.005 0.0069
Echinococcus multilocularis expressed conserved protein 0.0101 0.0326 0.0466
Loa Loa (eye worm) hypothetical protein 0.0063 0.0178 0.1459
Schistosoma mansoni tyrosine kinase 0.0046 0.0115 0.0652
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.028 0.0386
Giardia lamblia Delta tubulin 0.0062 0.0177 0.0591
Plasmodium vivax tubulin epsilon chain, putative 0.0144 0.0492 0.1804
Brugia malayi Tubulin alpha chain 0.0062 0.0177 0.0244
Brugia malayi CXXC zinc finger family protein 0.0028 0.0044 0.0061
Brugia malayi hypothetical protein 0.0026 0.0036 0.0049
Echinococcus multilocularis tar DNA binding protein 0.0069 0.0205 0.0281
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0142 0.0457
Mycobacterium leprae cell division protein FtsZ 0.0062 0.0177 1
Brugia malayi TAR-binding protein 0.0069 0.0205 0.0282
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0099 0.0333
Mycobacterium ulcerans monoamine oxidase 0.0042 0.0099 0.0395
Loa Loa (eye worm) hypothetical protein 0.003 0.005 0.0348
Brugia malayi AMP-binding enzyme family protein 0.0026 0.0035 0.0049
Echinococcus multilocularis protein dispatched 1 0.0052 0.0139 0.0181
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0087 0.046
Mycobacterium tuberculosis Conserved hypothetical protein 0.0157 0.0544 0.2573
Giardia lamblia Beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0044 0.0296
Echinococcus granulosus tubulin beta 1 chain 0.0144 0.0492 0.3223
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0026 0.0035 0.0112
Brugia malayi tubulin alpha-2 chain 0.0267 0.097 0.1338
Loa Loa (eye worm) hypothetical protein 0.0026 0.0035 0.022
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0062 0.0177 0.0591
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Onchocerca volvulus 0.0089 0.028 0.0246
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Trypanosoma cruzi tubulin delta chain 0.0062 0.0177 0.0591
Brugia malayi AMP-binding enzyme family protein 0.0026 0.0035 0.0049
Chlamydia trachomatis protoporphyrinogen oxidase 0.0042 0.0099 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0081 0.025 0.2427
Loa Loa (eye worm) hypothetical protein 0.0204 0.0728 0.624
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0036 0.006
Brugia malayi ShTK domain containing protein 0.0089 0.028 0.0386
Echinococcus multilocularis Tubulin beta 2C chain 0.0144 0.0492 0.0719
Leishmania major gamma-tubulin 0.0144 0.0492 0.1774
Trypanosoma cruzi beta tubulin, putative 0.0144 0.0492 0.1774
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0042 0.0099 0.0333
Giardia lamblia Epsilon tubulin 0.0062 0.0177 0.0591
Schistosoma mansoni alpha tubulin 0.0267 0.097 0.6482
Loa Loa (eye worm) hypothetical protein 0.0046 0.0114 0.09
Echinococcus multilocularis epidermal growth factor receptor 0.0078 0.0238 0.0332
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Schistosoma mansoni alpha tubulin 0.0267 0.097 0.6482
Toxoplasma gondii alpha-tubulin I, putative 0.0267 0.097 0.3568
Brugia malayi SWIRM domain containing protein 0.0042 0.0099 0.0136
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0708 0.2684 1
Schistosoma mansoni amine oxidase 0.0042 0.0099 0.054
Echinococcus multilocularis Tubulin beta 2C chain 0.0144 0.0492 0.0719
Plasmodium vivax tubulin alpha chain, putative 0.0267 0.097 0.3591
Echinococcus granulosus Niemann Pick C1 protein 0.0153 0.0529 0.3476
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.0126 0.0162
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0036 0.006
Schistosoma mansoni hypothetical protein 0.04 0.1486 1
Giardia lamblia Beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) hypothetical protein 0.0026 0.0036 0.0222
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0026 0.0035 0.0112
Echinococcus multilocularis Tubulin beta 2C chain 0.0144 0.0492 0.0719
Loa Loa (eye worm) tubulin alpha chain 0.0267 0.097 0.8342
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Schistosoma mansoni transient receptor potential channel 4 0.01 0.0322 0.206
Loa Loa (eye worm) tubulin alpha chain 0.0267 0.097 0.8342
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus tubulin gamma 1 chain 0.0144 0.0492 0.3223
Trypanosoma brucei alpha tubulin 0.0267 0.097 0.3568
Trypanosoma cruzi UDP-galactopyranose mutase 0.0042 0.0099 0.0297
Entamoeba histolytica hypothetical protein 0.0024 0.0028 0.009
Plasmodium vivax telomerase reverse transcriptase, putative 0.0708 0.2684 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0042 0.0099 0.054
Brugia malayi RNA, U transporter 1 0.0084 0.0262 0.0361
Schistosoma mansoni tubulin subunit alpha 0.0267 0.097 0.6482
Echinococcus granulosus tubulin alpha chain 0.0267 0.097 0.6482
Trypanosoma cruzi tubulin gamma chain 0.0144 0.0492 0.1774
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0267 0.097 1
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0599 0.226 1
Brugia malayi tubulin alpha chain - mouse 0.0267 0.097 0.1338
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.002 0.0027
Plasmodium falciparum alpha tubulin 1 0.0267 0.097 0.3591
Brugia malayi AMP-binding enzyme family protein 0.0026 0.0035 0.0049
Loa Loa (eye worm) TK/EGFR protein kinase 0.0145 0.0499 0.4246
Loa Loa (eye worm) TK/INSR protein kinase 0.0046 0.0115 0.0914
Entamoeba histolytica hypothetical protein 0.0039 0.0087 0.0709
Echinococcus multilocularis beta tubulin 0.0144 0.0492 0.0719
Schistosoma mansoni tyrosine kinase 0.0078 0.0238 0.1489
Echinococcus granulosus short transient receptor potential channel 6 0.0066 0.0191 0.1167
Echinococcus multilocularis tubulin subunit beta 0.0144 0.0492 0.0719
Schistosoma mansoni alpha tubulin 0.0267 0.097 0.6482
Trichomonas vaginalis tubulin gamma chain, putative 0.0144 0.0492 0.4971
Brugia malayi Tubulin alpha-2 chain 0.0267 0.097 0.1338
Echinococcus granulosus alpha tubulin 0.0267 0.097 0.6482
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0042 0.0099 0.0395
Echinococcus granulosus beta tubulin 0.0144 0.0492 0.3223
Trichomonas vaginalis tubulin epsilon chain, putative 0.0144 0.0492 0.4971
Plasmodium vivax tubulin gamma chain, putative 0.0144 0.0492 0.1804
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0316 0.1161 1
Schistosoma mansoni tyrosine kinase 0.0077 0.0235 0.1467
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0145 0.0496 0.0726
Echinococcus granulosus lysine specific histone demethylase 1A 0.0042 0.0099 0.054
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Echinococcus granulosus tubulin alpha 3 chain 0.0267 0.097 0.6482
Echinococcus multilocularis importin subunit beta 1 0.003 0.005 0.0046
Echinococcus multilocularis hypothetical protein 0.0267 0.097 0.1447
Echinococcus multilocularis short transient receptor potential channel 6 0.0066 0.0191 0.0261
Trypanosoma cruzi zeta tubulin, putative 0.0062 0.0177 0.0591
Echinococcus granulosus tubulin alpha 1C chain 0.0267 0.097 0.6482
Toxoplasma gondii beta tubulin 0.0144 0.0492 0.1774
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.001 0.002
Echinococcus granulosus tubulin subunit beta 0.0144 0.0492 0.3223
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0028 0.009
Entamoeba histolytica tubulin family protein 0.0144 0.0492 0.4971
Echinococcus multilocularis tubulin alpha 3 chain 0.0267 0.097 0.1447
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0298 0.1091 0.402
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0028 0.009
Echinococcus multilocularis Tubulin beta 2C chain 0.0144 0.0492 0.0719
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Trichomonas vaginalis tubulin gamma chain, putative 0.0144 0.0492 0.4971
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.0126 0.0726
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.0035 0.0112
Leishmania major telomerase reverse transcriptase, putative 0.0708 0.2684 1
Plasmodium vivax tubulin alpha chain, putative 0.0267 0.097 0.3591
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.028 0.0386
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Schistosoma mansoni tyrosine kinase 0.0145 0.0499 0.3267
Schistosoma mansoni tar DNA-binding protein 0.0069 0.0205 0.126
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.0035 0.0059
Trypanosoma cruzi zeta tubulin, putative 0.0062 0.0177 0.0591
Treponema pallidum cell division protein FtsZ 0.0062 0.0177 0.5
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0037 0.0079 0.009
Brugia malayi Hypothetical tyrosinase-like protein F21C3.2 in chromosome I 0.0089 0.028 0.0386
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.002 0.0084
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0036 0.006
Echinococcus granulosus Tubulin beta 2C chain 0.0144 0.0492 0.3223
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0204 0.0728 0.7455
Echinococcus multilocularis tubulin alpha chain 0.0267 0.097 0.1447
Schistosoma mansoni tyrosine kinase 0.0046 0.0115 0.0652
Echinococcus granulosus Tubulin beta 2C chain 0.0144 0.0492 0.3223
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.005 0.0114
Echinococcus granulosus tubulin alpha chain 0.0267 0.097 0.6482
Echinococcus multilocularis tubulin alpha 1C chain 0.0267 0.097 0.1447
Leishmania major hypothetical protein, conserved 0.0026 0.0036 0.006
Loa Loa (eye worm) tubulin beta chain 0.0144 0.0492 0.4189
Trypanosoma brucei zeta tubulin 0.0062 0.0177 0.0591
Echinococcus granulosus geminin 0.0167 0.0584 0.3845
Trypanosoma brucei alpha tubulin, putative 0.0081 0.025 0.0866
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0042 0.0099 0.0121
Leishmania major epsilon tubulin, putative 0.0144 0.0492 0.1774
Echinococcus granulosus Tubulin alpha 1 chain 0.0267 0.097 0.6482
Mycobacterium tuberculosis Cell division protein FtsZ 0.0062 0.0177 0.0819
Giardia lamblia Alpha-tubulin 0.0267 0.097 0.3568
Giardia lamblia Beta tubulin 0.0144 0.0492 0.1774
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0141 0.0482 0.1735
Schistosoma mansoni tyrosine kinase 0.0077 0.0235 0.1467
Echinococcus granulosus beta tubulin 0.0144 0.0492 0.3223
Echinococcus multilocularis peroxisome assembly protein 26 0.0267 0.097 0.1447
Echinococcus granulosus TRP transient receptor potential channel 0.0037 0.0079 0.0404
Trypanosoma brucei alpha tubulin 0.0267 0.097 0.3568
Trypanosoma brucei epsilon tubulin 0.0144 0.0492 0.1774
Toxoplasma gondii alpha tubulin TUBA1 0.0267 0.097 0.3568
Echinococcus multilocularis Tubulin alpha 1 chain 0.0267 0.097 0.1447
Echinococcus granulosus tubulin alpha chain 0.0267 0.097 0.6482
Loa Loa (eye worm) ShTK domain-containing protein 0.0089 0.028 0.2346
Trypanosoma cruzi epsilon tubulin, putative 0.0144 0.0492 0.1774
Trypanosoma brucei beta tubulin 0.0144 0.0492 0.1774
Entamoeba histolytica tubulin gamma chain 0.0144 0.0492 0.4971
Plasmodium falciparum importin beta, putative 0.003 0.005 0.015
Mycobacterium tuberculosis Possible oxidoreductase 0.0042 0.0099 0.0445
Loa Loa (eye worm) tubulin gamma chain 0.0144 0.0492 0.4189
Schistosoma mansoni tar DNA-binding protein 0.0069 0.0205 0.126
Echinococcus granulosus Protein patched homolog 1 0.0046 0.0114 0.064
Echinococcus multilocularis tubulin alpha chain 0.0267 0.097 0.1447
Mycobacterium ulcerans oxidoreductase 0.0042 0.0099 0.0395
Trypanosoma brucei alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus insulin receptor 0.0046 0.0115 0.0652
Echinococcus granulosus peroxisome assembly protein 26 0.0267 0.097 0.6482
Echinococcus granulosus tubulin alpha chain 0.0267 0.097 0.6482
Echinococcus multilocularis tubulin beta 1 chain 0.0144 0.0492 0.0719
Echinococcus granulosus importin subunit beta 1 0.003 0.005 0.0207
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0046 0.0114 0.09
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.0035 0.0164
Onchocerca volvulus 0.0089 0.028 0.0246
Leishmania major UDP-galactopyranose mutase 0.0042 0.0099 0.0297
Schistosoma mansoni tyrosinase precursor 0.0089 0.028 0.1776
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.0496 0.3251
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.0035 0.0112
Schistosoma mansoni hypothetical protein 0.0039 0.0087 0.046
Brugia malayi hypothetical protein 0.0042 0.0099 0.0136
Loa Loa (eye worm) hypothetical protein 0.0106 0.0348 0.2935
Plasmodium falciparum tubulin delta chain, putative 0.0062 0.0177 0.0625
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Schistosoma mansoni tyrosine kinase 0.0078 0.0238 0.1489
Echinococcus multilocularis protein patched 0.0046 0.0114 0.0143
Echinococcus multilocularis 0.0045 0.011 0.0137
Loa Loa (eye worm) hypothetical protein 0.0056 0.0154 0.1249
Brugia malayi Tubulin alpha chain 0.0267 0.097 0.1338
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.0126 0.0726
Schistosoma mansoni hypothetical protein 0.0044 0.0107 0.0597
Echinococcus multilocularis beta tubulin 0.0144 0.0492 0.0719
Echinococcus multilocularis protoporphyrinogen oxidase 0.0042 0.0099 0.0121
Echinococcus granulosus Tubulin alpha 1 chain 0.0267 0.097 0.6482
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Toxoplasma gondii hypothetical protein 0.0048 0.0122 0.0382
Schistosoma mansoni cpg binding protein 0.0028 0.0044 0.0166
Echinococcus granulosus tubulin epsilon chain 0.0144 0.0492 0.3223
Schistosoma mansoni hypothetical protein 0.0167 0.0584 0.3845
Brugia malayi Common central domain of tyrosinase family protein 0.0089 0.028 0.0386
Loa Loa (eye worm) hypothetical protein 0.0186 0.0655 0.5603
Echinococcus multilocularis tubulin alpha 1C chain 0.0267 0.097 0.1447
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0557 0.2097 1
Trypanosoma brucei tubulin delta chain 0.0062 0.0177 0.0591
Echinococcus granulosus tubulin alpha 0.0144 0.0492 0.3223
Echinococcus granulosus sterol regulatory element binding protein 0.0046 0.0114 0.064
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0036 0.0096
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0042 0.0098 0.0293
Trypanosoma brucei epsilon tubulin 0.0144 0.0492 0.1774
Schistosoma mansoni importin beta-1 0.003 0.005 0.0207
Loa Loa (eye worm) tyrosinase 1 0.0089 0.028 0.2346
Echinococcus granulosus epidermal growth factor receptor 0.0078 0.0238 0.1489
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0145 0.0496 0.0685
Loa Loa (eye worm) alpha-tubulin 0.0267 0.097 0.8342
Echinococcus multilocularis short transient receptor potential channel 6 0.0066 0.0191 0.0261
Giardia lamblia Alpha-tubulin 0.0267 0.097 0.3568
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0078 0.0238 0.1489
Schistosoma mansoni hypothetical protein 0.0049 0.0126 0.0726
Trypanosoma brucei epsilon tubulin 0.0144 0.0492 0.1774
Echinococcus granulosus tubulin alpha 3 chain 0.0267 0.097 0.6482
Onchocerca volvulus 0.0042 0.0099 0.0064
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0042 0.0099 0.0333
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.0035 0.0112
Trypanosoma brucei beta tubulin 0.0144 0.0492 0.1774
Echinococcus multilocularis insulin receptor 0.0046 0.0115 0.0145
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.002 0.0036
Loa Loa (eye worm) tubulin alpha 2 0.0123 0.0413 0.3502
Schistosoma mansoni tar DNA-binding protein 0.0069 0.0205 0.126
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.002 0.0036
Echinococcus granulosus Tubulin alpha 1 chain 0.0267 0.097 0.6482
Schistosoma mansoni hypothetical protein 0.0044 0.0107 0.0597
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0062 0.0177 0.0591
Leishmania major importin beta-1 subunit, putative 0.0024 0.0028 0.0032
Schistosoma mansoni tubulin subunit beta 0.0062 0.0177 0.1073
Toxoplasma gondii RNA-directed DNA polymerase 0.0708 0.2684 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0066 0.0487
Onchocerca volvulus 0.0028 0.0044 0.0009
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0133 0.0426
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0026 0.0035 0.0112
Trichomonas vaginalis tubulin gamma chain, putative 0.0062 0.0177 0.1655
Echinococcus multilocularis GPCR, family 2 0.0049 0.0126 0.0162
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0141 0.0482 0.1735
Loa Loa (eye worm) alpha-tubulin 0.0267 0.097 0.8342
Trypanosoma brucei tubulin gamma chain 0.0144 0.0492 0.1774
Loa Loa (eye worm) tubulin beta-1 chain 0.0144 0.0492 0.4189
Schistosoma mansoni hypothetical protein 0.0167 0.0584 0.3845
Schistosoma mansoni hypothetical protein 0.0044 0.0107 0.0597
Entamoeba histolytica hypothetical protein 0.0039 0.0087 0.0709
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0081 0.025 0.2427
Echinococcus multilocularis Tubulin alpha 1 chain 0.0267 0.097 0.1447
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Leishmania major alpha tubulin 0.0267 0.097 0.3568
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0042 0.0099 0.0333
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0044 0.0106 0.0322
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0046 0.0115 0.0652
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Loa Loa (eye worm) hypothetical protein 0.0156 0.0539 0.4594
Trichomonas vaginalis tubulin beta chain, putative 0.0267 0.097 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0144 0.0492 0.1774
Echinococcus granulosus cpg binding protein 0.003 0.005 0.0209
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.0114 0.0988
Echinococcus multilocularis tubulin gamma 1 chain 0.0144 0.0492 0.0719
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.0496 0.3251
Brugia malayi beta-tubulin, identical 0.0144 0.0492 0.0679
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0026 0.0035 0.0112
Brugia malayi RNA recognition motif domain containing protein 0.0069 0.0205 0.0282
Loa Loa (eye worm) TAR-binding protein 0.0069 0.0205 0.1689
Echinococcus granulosus tubulin alpha 1C chain 0.0267 0.097 0.6482
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0087 0.0103
Trypanosoma cruzi alpha tubulin, putative 0.0267 0.097 0.3568
Plasmodium falciparum tubulin gamma chain 0.0144 0.0492 0.1804
Schistosoma mansoni cpg binding protein 0.003 0.005 0.0209
Brugia malayi RNA binding protein 0.0069 0.0205 0.0282
Echinococcus multilocularis tubulin alpha chain 0.0267 0.097 0.1447
Echinococcus multilocularis transient receptor potential ion channel A 0.0096 0.0309 0.044
Leishmania major beta tubulin 0.0144 0.0492 0.1774
Loa Loa (eye worm) hypothetical protein 0.0042 0.0099 0.0772
Schistosoma mansoni tubulin subunit beta 0.0144 0.0492 0.3223
Echinococcus granulosus Niemann Pick C1 protein 0.0107 0.0351 0.2259
Trypanosoma brucei alpha tubulin 0.0267 0.097 0.3568
Echinococcus granulosus lysine specific histone demethylase 1A 0.0042 0.0099 0.054
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0042 0.0099 0.0333
Brugia malayi Tubulin beta-1 chain 0.0144 0.0492 0.0679
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0298 0.1091 0.402
Echinococcus multilocularis tubulin epsilon chain 0.0144 0.0492 0.0719
Mycobacterium ulcerans hypothetical protein 0.0157 0.0544 0.2372
Echinococcus granulosus dnaJ subfamily B 0.04 0.1486 1
Echinococcus granulosus tar DNA binding protein 0.0069 0.0205 0.126
Entamoeba histolytica hypothetical protein 0.0039 0.0087 0.0709
Schistosoma mansoni hypothetical protein 0.0316 0.1161 0.7784
Plasmodium falciparum tubulin beta chain 0.0144 0.0492 0.1804
Loa Loa (eye worm) tubulin alpha-3 chain 0.0186 0.0655 0.5603
Onchocerca volvulus 0.0089 0.028 0.0246
Echinococcus multilocularis tubulin alpha chain 0.0267 0.097 0.1447
Giardia lamblia Telomerase catalytic subunit 0.0708 0.2684 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0069 0.0205 0.1689
Echinococcus granulosus epidermal growth factor receptor 0.0145 0.0499 0.3267
Brugia malayi Niemann-Pick C1 protein precursor 0.0107 0.0351 0.0484
Echinococcus multilocularis 0.0042 0.0099 0.0121

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 305 nM Displacement of [125I]MCP1 from human CCR2 in PBMC after 30 mins by gamma counting ChEMBL. 24900280

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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