Detailed information for compound 1973727

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 465.512 | Formula: C23H30F3N5O2
  • H donors: 3 H acceptors: 4 LogP: 3.77 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC([C@@H]1CC[C@@H](CC1)N1CC(C1)NC(=O)CNc1ncnc2c1cc(cc2)C(F)(F)F)O
  • InChi: 1S/C23H30F3N5O2/c1-2-20(32)14-3-6-17(7-4-14)31-11-16(12-31)30-21(33)10-27-22-18-9-15(23(24,25)26)5-8-19(18)28-13-29-22/h5,8-9,13-14,16-17,20,32H,2-4,6-7,10-12H2,1H3,(H,30,33)(H,27,28,29)/t14-,17+,20?
  • InChiKey: LKAYCEHIZZCMRB-SXOGMHNXSA-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-like 2 Starlite/ChEMBL No 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
Schistosoma mansoni insulysin (M16 family) 0.0015 0.0175 0.0353
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0014 0.0135 0.0107
Schistosoma mansoni nuclear hormone receptor 0.0016 0.0228 0.0459
Loa Loa (eye worm) hypothetical protein 0.0018 0.0318 0.0318
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0016 0.0228 0.0228
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0016 0.0228 0.0207
Brugia malayi Furin-like cysteine rich region family protein 0.0054 0.2032 0.2032
Brugia malayi nuclear hormone receptor family member odr-7 0.0016 0.0228 0.0228
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0119 0.5102 0.54
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.1072 0.1072
Trypanosoma cruzi lanosterol synthase, putative 0.0026 0.0725 0.1497
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Brugia malayi Protein kinase domain containing protein 0.0065 0.2562 0.2562
Plasmodium vivax cysteine repeat modular protein 2, putative 0.0018 0.0304 0.0008
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0013 0.0098 0.0198
Plasmodium falciparum protein farnesyltransferase subunit beta 0.0024 0.0615 0.296
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0018 0.0303 0.1264
Echinococcus granulosus replication protein A 70 kDa DNA binding 0.0083 0.3398 0.3593
Loa Loa (eye worm) hypothetical protein 0.0019 0.0353 0.0353
Loa Loa (eye worm) TK/EPH protein kinase 0.0097 0.4064 0.4064
Loa Loa (eye worm) hypothetical protein 0.0074 0.2959 0.2959
Brugia malayi protein-tyrosine kinase 0.0048 0.1726 0.1726
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0053 0.196 0.2037
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.1072 0.1072
Brugia malayi Calcitonin receptor-like protein seb-1 0.0044 0.1562 0.1562
Echinococcus granulosus tyrosine protein kinase Blk 0.0048 0.1726 0.1806
Echinococcus multilocularis tyrosine protein kinase Srms 0.0048 0.1726 0.1786
Loa Loa (eye worm) hypothetical protein 0.0014 0.0131 0.0131
Echinococcus granulosus tm gpcr rhodopsin 0.021 0.9398 1
Schistosoma mansoni nuclear receptor nhr-48 0.0016 0.0228 0.0459
Leishmania major replication factor A, 51kDa subunit, putative 0.004 0.1355 1
Entamoeba histolytica protein kinase, putative 0.0042 0.1485 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0034 0.1072 0.1072
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.1072 0.1087
Plasmodium falciparum telomerase reverse transcriptase 0.0034 0.1092 0.7502
Loa Loa (eye worm) BRCA2 repeat family protein 0.0017 0.0267 0.0267
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0013 0.0098 0.0044
Brugia malayi conserved hypotetical protein 0.0016 0.0228 0.0228
Plasmodium vivax cysteine repeat modular protein 3, putative 0.0018 0.0304 0.0008
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0034 0.1072 0.1072
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0034 0.1072 0.2157
Toxoplasma gondii kringle domain-containing protein 0.0018 0.0304 0.1268
Echinococcus granulosus tyrosine protein kinase HCK 0.0042 0.1485 0.155
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0034 0.1072 0.1109
Schistosoma mansoni zinc finger protein 0.0016 0.0228 0.0459
Echinococcus multilocularis ephrin type A receptor 4 A 0.0094 0.3939 0.4156
Echinococcus multilocularis nardilysin 0.0027 0.0736 0.0726
Schistosoma mansoni thyroid hormone receptor 0.0034 0.1072 0.2157
Echinococcus multilocularis c src tyrosine kinase 0.0013 0.0098 0.0044
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Brugia malayi Nuclear hormone receptor-like 1 0.0034 0.1072 0.1072
Brugia malayi GCC2 and GCC3 family protein 0.0018 0.0304 0.0304
Schistosoma mansoni tyrosine kinase 0.0116 0.4971 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.0053 0.196 0.2057
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0034 0.1072 0.1986
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0016 0.0228 0.0207
Echinococcus granulosus insulin degrading enzyme 0.0027 0.0736 0.0749
Echinococcus granulosus tyrosine protein kinase Fyn 0.0053 0.196 0.2057
Echinococcus granulosus tyrosine protein kinase Src42A 0.0053 0.196 0.2057
Echinococcus granulosus nardilysin 0.0027 0.0736 0.0749
Schistosoma mansoni tyrosine kinase 0.0053 0.196 0.3943
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0034 0.1072 0.1109
Schistosoma mansoni hypothetical protein 0.0014 0.0135 0.0271
Echinococcus granulosus tyrosine kinase 0.0048 0.1726 0.1806
Trypanosoma brucei peptidase, putative 0.0027 0.0736 0.4696
Brugia malayi GCC2 and GCC3 family protein 0.002 0.0412 0.0412
Schistosoma mansoni hypothetical protein 0.0018 0.0304 0.0612
Leishmania major phosphoglycan beta 1,3 galactosyltransferase 5 0.0027 0.0736 0.5227
Giardia lamblia Telomerase catalytic subunit 0.0034 0.1092 1
Echinococcus multilocularis insulin receptor 0.0116 0.4971 0.526
Loa Loa (eye worm) TK protein kinase 0.0042 0.1485 0.1485
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0012 0.0059 0.0059
Echinococcus granulosus laminin 0.0012 0.0059 0.0027
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0018 0.0303 0.0264
Onchocerca volvulus Putative replication factor A 73 kDa subunit 0.0074 0.2986 0.5531
Loa Loa (eye worm) SRC-1 0.0053 0.196 0.196
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0016 0.0228 0.0183
Schistosoma mansoni nardilysin (M16 family) 0.0027 0.0736 0.148
Echinococcus granulosus ecdysone induced protein 78C 0.0034 0.1072 0.1109
Schistosoma mansoni nuclear hormone receptor 0.0016 0.0228 0.0459
Plasmodium falciparum cysteine repeat modular protein 4 0.0018 0.0304 0.0008
Plasmodium falciparum cysteine repeat modular protein 2 0.0018 0.0304 0.0008
Echinococcus granulosus nuclear receptor nhr 48 0.0016 0.0228 0.0207
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0079 0.3205 0.9375
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0016 0.0228 0.0228
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0014 0.0135 0.0083
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0053 0.196 0.2037
Schistosoma mansoni tyrosine kinase 0.0053 0.196 0.3943
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0083 0.3398 1
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0038 0.1288 0.2591
Plasmodium falciparum cysteine repeat modular protein 1 0.0018 0.0304 0.0008
Brugia malayi photoreceptor-specific nuclear receptor 0.0034 0.1072 0.1072
Brugia malayi BRCA2 repeat family protein 0.0017 0.0267 0.0267
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0034 0.1092 0.6452
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0044 0.1576 0.1626
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.0024 0.0615 0.0615
Loa Loa (eye worm) hypothetical protein 0.002 0.0412 0.0412
Brugia malayi tailless protein 0.0016 0.0228 0.0228
Schistosoma mansoni tyrosine kinase 0.0116 0.4971 1
Schistosoma mansoni ephrin receptor 0.0077 0.3109 0.6255
Entamoeba histolytica replication factor A protein 1, putative 0.0036 0.1162 0.7259
Schistosoma mansoni insulysin unit 3 (M16 family) 0.0027 0.0736 0.148
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0034 0.1072 0.2157
Echinococcus multilocularis replication protein A 70 kDa DNA binding 0.0083 0.3398 0.3577
Echinococcus granulosus epidermal growth factor receptor 0.0054 0.2032 0.2134
Echinococcus granulosus tyrosine protein kinase Fyn 0.0053 0.196 0.2057
Echinococcus multilocularis laminin 0.0012 0.0059 0.0002
Schistosoma mansoni coup transcription factor 0.0034 0.1072 0.2157
Schistosoma mansoni nuclear hormone receptor 0.0034 0.1072 0.2157
Schistosoma mansoni replication factor A 1 rfa1 0.0083 0.3398 0.6837
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0018 0.0318 0.064
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0016 0.0228 0.0459
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.1072 0.1109
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0053 0.196 0.2037
Echinococcus granulosus ephrin type A receptor 4 A 0.0094 0.3939 0.417
Trichomonas vaginalis geranylgeranyl transferase type beta subunit, putative 0.0024 0.0615 0.1006
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0119 0.5102 0.5412
Toxoplasma gondii calcium binding egf domain-containing protein 0.0012 0.0059 0.0117
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0018 0.0303 0.061
Onchocerca volvulus 0.0019 0.0363 0.0673
Echinococcus granulosus insulin receptor 0.0116 0.4971 0.5272
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.1072 0.1087
Echinococcus multilocularis tyrosine protein kinase HCK 0.0042 0.1485 0.1529
Brugia malayi hypothetical protein 0.0018 0.0318 0.0318
Loa Loa (eye worm) TK protein kinase 0.0048 0.1726 0.1726
Echinococcus multilocularis FTZ F1 alpha 0.0034 0.1072 0.1087
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Echinococcus granulosus GPCR family 2 0.0014 0.0135 0.0107
Trichomonas vaginalis type I geranylgeranyltransferase beta subunit, putative 0.0024 0.0615 0.1006
Schistosoma mansoni cathepsin D (A01 family) 0.0052 0.1919 0.3862
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0014 0.0135 0.0083
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Loa Loa (eye worm) AStacin protease 0.0024 0.0608 0.0608
Schistosoma mansoni tyrosine kinase 0.0054 0.2032 0.4088
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0024 0.0615 0.2726
Echinococcus granulosus thyroid hormone receptor alpha 0.0016 0.0228 0.0207
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0034 0.1072 0.1087
Leishmania major telomerase reverse transcriptase, putative 0.0034 0.1092 0.7976
Loa Loa (eye worm) insulin-degrading enzyme 0.0027 0.0736 0.0736
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0053 0.196 0.2057
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Onchocerca volvulus 0.0019 0.0353 0.0653
Echinococcus granulosus sodium channel protein 0.0012 0.0057 0.0025
Schistosoma mansoni protein farnesyltransferase subunit beta 0.0024 0.0615 0.1237
Toxoplasma gondii OB-fold nucleic acid binding domain-containing protein 0.0021 0.046 0.2
Schistosoma mansoni hypothetical protein 0.0014 0.0135 0.0271
Loa Loa (eye worm) hypothetical protein 0.0044 0.1562 0.1562
Loa Loa (eye worm) replication factor A 73 kDa subunit 0.0083 0.3398 0.3398
Plasmodium vivax hypothetical protein, conserved 0.0018 0.0304 0.0008
Echinococcus multilocularis GPCR, family 2 0.0014 0.0135 0.0083
Echinococcus multilocularis nardilysin 0.0027 0.0736 0.0726
Brugia malayi hypothetical protein 0.0018 0.0318 0.0318
Brugia malayi ecdysone receptor 0.0016 0.0228 0.0228
Brugia malayi Telomerase reverse transcriptase 0.0091 0.3781 0.3781
Echinococcus granulosus FTZ F1 alpha 0.0034 0.1072 0.1109
Brugia malayi steroid hormone receptor 0.0034 0.1072 0.1072
Echinococcus multilocularis endonuclease reverse transcriptase 0.0018 0.0304 0.0265
Entamoeba histolytica protein farnesyltransferase beta subunit, putative 0.0024 0.0615 0.2628
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.0228 0.0207
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0013 0.0098 0.0068
Echinococcus granulosus tyrosine protein kinase Src64B 0.0053 0.196 0.2057
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Trypanosoma brucei lanosterol synthase 0.0026 0.0725 0.4609
Toxoplasma gondii rhoptry metalloprotease toxolysin TLN1 0.0027 0.0736 0.3294
Toxoplasma gondii peptidase M16 inactive domain-containing protein 0.0016 0.0237 0.0954
Brugia malayi hypothetical protein 0.0091 0.3779 0.3779
Trypanosoma cruzi lanosterol synthase, putative 0.0026 0.0725 0.1497
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0034 0.1072 0.1072
Brugia malayi replication factor A 73 kDa subunit 0.0083 0.3398 0.3398
Schistosoma mansoni tyrosine kinase 0.0051 0.1883 0.3787
Plasmodium falciparum replication protein A1, large subunit 0.004 0.1355 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Onchocerca volvulus 0.0074 0.2959 0.5481
Loa Loa (eye worm) nuclear receptor NHR-67 0.0016 0.0228 0.0228
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0018 0.0303 0.0303
Loa Loa (eye worm) hypothetical protein 0.0012 0.0059 0.0059
Toxoplasma gondii sporozoite developmental protein 0.0027 0.0736 0.3294
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0024 0.0615 0.1006
Schistosoma mansoni hypothetical protein 0.0014 0.0135 0.0271
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0034 0.1072 0.1087
Chlamydia trachomatis insulinase family protease III 0.0027 0.0736 0.5
Loa Loa (eye worm) TK/INSR protein kinase 0.0116 0.4971 0.4971
Schistosoma mansoni RAR-like nuclear receptor 0.0034 0.1072 0.2157
Toxoplasma gondii replication factor-a protein 1 (rpa1) subfamily protein 0.004 0.1355 0.6203
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0034 0.1072 0.1072
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0034 0.1072 0.1072
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0034 0.1072 0.1072
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0016 0.0228 0.0422
Echinococcus granulosus protein farnesyltransferase subunit beta 0.0024 0.0615 0.062
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0034 0.1072 0.1072
Brugia malayi nuclear hormone receptor 0.0016 0.0228 0.0228
Brugia malayi latrophilin 2 splice variant baaae 0.003 0.0901 0.0901
Toxoplasma gondii insulysin, putative 0.0025 0.0674 0.3003
Brugia malayi nuclear receptor RXR 0.0016 0.0228 0.0228
Trypanosoma cruzi Replication factor A protein 1 0.004 0.1355 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0135 0.0135
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.0228 0.0207
Schistosoma mansoni nuclear receptor 0.0016 0.0228 0.0459
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0034 0.1072 0.1072
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0018 0.0303 0.0288
Toxoplasma gondii hypothetical protein 0.0018 0.0304 0.1268
Echinococcus multilocularis epidermal growth factor receptor 0.0054 0.2032 0.2114
Schistosoma mansoni tyrosine kinase 0.0054 0.2032 0.4088
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0018 0.0318 0.0304
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0038 0.1288 0.1288
Plasmodium vivax telomerase reverse transcriptase, putative 0.0034 0.1092 0.7502
Brugia malayi ecdysteroid receptor 0.0034 0.1072 0.1072
Brugia malayi nuclear receptor NHR-67 0.0016 0.0228 0.0228
Brugia malayi orphan nuclear receptor NR2E1 0.0016 0.0228 0.0228
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0014 0.0135 0.0135
Trypanosoma cruzi peptidase, putative 0.0027 0.0736 0.1633
Echinococcus multilocularis protein farnesyltransferase subunit beta 0.0024 0.0615 0.0597
Schistosoma mansoni steroid hormone receptor ad4bp 0.0034 0.1072 0.2157
Schistosoma mansoni tyrosine kinase 0.0054 0.2032 0.4088
Echinococcus multilocularis epidermal growth factor receptor 0.0054 0.2032 0.2114
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0034 0.1072 0.1109
Onchocerca volvulus Bile acid receptor homolog 0.0034 0.1072 0.1986
Schistosoma mansoni tyrosine kinase 0.0051 0.1883 0.3787
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0024 0.0615 0.1006
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0012 0.0057 0.0025
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0034 0.1072 0.2157
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0014 0.0135 0.0107
Loa Loa (eye worm) hypothetical protein 0.0037 0.1214 0.1214
Brugia malayi nuclear hormone receptor family member nhr-6 0.0016 0.0228 0.0228
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0034 0.1092 0.6452
Toxoplasma gondii RNA-directed DNA polymerase 0.0034 0.1092 0.4969
Schistosoma mansoni insulysin unit 3 (M16 family) 0.0027 0.0736 0.148
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.0024 0.0615 0.0615
Brugia malayi Steroid receptor seven-up type 2 0.0034 0.1072 0.1072
Schistosoma mansoni cathepsin D (A01 family) 0.0052 0.1919 0.3862
Brugia malayi Tyrosine-protein kinase abl-1 0.0013 0.0098 0.0098
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.1072 0.1072
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.021 0.9398 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0034 0.1072 0.1109
Trypanosoma brucei protein farnesyltransferase beta subunit 0.0024 0.0615 0.366
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0053 0.196 0.2037
Echinococcus multilocularis tyrosine protein kinase Abl 0.0013 0.0098 0.0044
Brugia malayi nuclear receptor RXR 0.0018 0.0318 0.0318
Loa Loa (eye worm) DR-78 0.0016 0.0228 0.0228
Onchocerca volvulus Telomerase reverse transcriptase homolog 0.0125 0.5399 1
Brugia malayi Latrophilin receptor protein 2 0.0014 0.0135 0.0135
Toxoplasma gondii PAN domain-containing protein 0.0057 0.2164 1
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0318 0.0318
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0016 0.0228 0.0422
Echinococcus multilocularis ecdysone induced protein 78C 0.0034 0.1072 0.1087
Echinococcus granulosus tyrosine protein kinase Src42A 0.0044 0.1576 0.1647
Plasmodium vivax conserved Plasmodium protein, unknown function 0.0018 0.0305 0.0018
Schistosoma mansoni tyrosine kinase 0.0051 0.1883 0.3787
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.0222 1 1
Brugia malayi hypothetical protein 0.0016 0.0228 0.0228
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0018 0.0318 0.0318
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Echinococcus multilocularis Tolloid protein 1 0.0038 0.1288 0.1318
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.1072 0.1072
Brugia malayi GCC2 and GCC3 family protein 0.0018 0.0304 0.0304
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0024 0.0615 0.1006
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0053 0.196 0.2057
Toxoplasma gondii calcium binding egf domain-containing protein 0.0012 0.0059 0.0117
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0048 0.1726 0.1786
Brugia malayi Calcium binding EGF domain containing protein 0.0012 0.0059 0.0059
Plasmodium vivax hypothetical protein, conserved 0.0018 0.0304 0.0008
Brugia malayi Nuclear hormone receptor E75 0.0016 0.0228 0.0228
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0018 0.0318 0.064
Brugia malayi GCC2 and GCC3 family protein 0.0018 0.0304 0.0304
Brugia malayi Protein kinase domain containing protein 0.0116 0.4971 0.4971
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0034 0.1072 0.2157
Schistosoma mansoni hypothetical protein 0.003 0.0901 0.1814
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0034 0.1072 0.2157
Echinococcus multilocularis thyroid hormone receptor alpha 0.0034 0.1072 0.1087
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.0228 0.0183
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Schistosoma mansoni hypothetical protein 0.0015 0.0187 0.0377
Brugia malayi nuclear hormone receptor 0.0034 0.1072 0.1072
Loa Loa (eye worm) hypothetical protein 0.0018 0.0318 0.0318
Echinococcus multilocularis nuclear receptor nhr 48 0.0016 0.0228 0.0183
Onchocerca volvulus Protein ultraspiracle homolog 0.0034 0.1072 0.1986
Leishmania major farnesyltransferase beta subunit 0.0024 0.0615 0.4295
Brugia malayi hypothetical protein 0.0016 0.0228 0.0228
Loa Loa (eye worm) hypothetical protein 0.0018 0.0318 0.0318
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0048 0.1726 0.1806
Loa Loa (eye worm) TK/EGFR protein kinase 0.0054 0.2032 0.2032
Schistosoma mansoni nardilysin (M16 family) 0.0027 0.0736 0.148
Loa Loa (eye worm) hypothetical protein 0.0018 0.0318 0.0318
Echinococcus granulosus endonuclease reverse transcriptase 0.0018 0.0304 0.0288
Plasmodium falciparum conserved protein, unknown function 0.0018 0.0304 0.0008
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.1072 0.1072
Brugia malayi nuclear receptor NHR-88 0.0034 0.1072 0.1072
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0034 0.1072 0.1087
Toxoplasma gondii GCC2 and GCC3 domain-containing protein 0.0018 0.0304 0.1268
Giardia lamblia CEGP1 protein 0.0018 0.0304 0.2454
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.1072 0.1109
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Brugia malayi Fibulin-1 precursor 0.0012 0.0059 0.0059
Loa Loa (eye worm) hypothetical protein 0.0037 0.1248 0.1248
Loa Loa (eye worm) hypothetical protein 0.003 0.0901 0.0901
Echinococcus multilocularis fibrillin 1 0.0012 0.0059 0.0002
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Giardia lamblia Prenyltransferase 0.0024 0.0615 0.5426
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0034 0.1072 0.1087
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0018 0.0318 0.028
Schistosoma mansoni tyrosine kinase 0.0013 0.0098 0.0198
Plasmodium vivax farnesyltransferase beta subunit, putative 0.0024 0.0615 0.296
Echinococcus granulosus tyrosine protein kinase Lyn 0.0053 0.196 0.2057
Onchocerca volvulus 0.0012 0.006 0.011
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0053 0.196 0.2037
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0034 0.1072 0.1072
Schistosoma mansoni hypothetical protein 0.0014 0.0135 0.0271
Brugia malayi insulin-degrading enzyme 0.0027 0.0736 0.0736
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0053 0.196 0.2037
Brugia malayi sulfakinin receptor protein 0.0091 0.3779 0.3779
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0034 0.1072 0.2157
Loa Loa (eye worm) latrophilin receptor protein 2 0.0014 0.0135 0.0135
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0083 0.3398 1
Onchocerca volvulus 0.0016 0.0228 0.0422
Brugia malayi nuclear receptor NHR-88 0.0016 0.0228 0.0228
Schistosoma mansoni nuclear receptor 0.0016 0.0228 0.0459
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0034 0.1072 0.1072
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0034 0.1072 0.1072
Echinococcus granulosus epidermal growth factor receptor 0.0054 0.2032 0.2134
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.0228 0.0183
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0034 0.1072 0.1109
Loa Loa (eye worm) hypothetical protein 0.0034 0.1072 0.1072
Schistosoma mansoni tyrosine kinase 0.0013 0.0098 0.0198
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0026 0.0725 0.5
Echinococcus granulosus c src tyrosine kinase 0.0013 0.0098 0.0068
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0016 0.0228 0.0459
Echinococcus multilocularis 0.0015 0.0178 0.013
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0053 0.196 0.2037
Brugia malayi SRC-1 0.0053 0.196 0.196
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0016 0.0228 0.0183
Loa Loa (eye worm) steroid hormone receptor 0.0034 0.1072 0.1072
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0018 0.0304 0.0008
Toxoplasma gondii aspartyl protease ASP1 0.0018 0.0303 0.1264
Plasmodium falciparum cysteine repeat modular protein 3 0.0018 0.0304 0.0008
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0318 0.0318
Toxoplasma gondii PAN domain-containing protein 0.0057 0.2164 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0213 0.0213
Loa Loa (eye worm) hypothetical protein 0.0091 0.3779 0.3779
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228
Loa Loa (eye worm) hypothetical protein 0.0019 0.0353 0.0353
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.0024 0.0615 0.1006
Echinococcus multilocularis tyrosine protein kinase Blk 0.0048 0.1726 0.1786
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0054 0.2032 0.2134
Trypanosoma brucei telomerase reverse transcriptase 0.0034 0.1092 0.7751
Echinococcus granulosus 3'partial|nardilysin 0.0027 0.0736 0.0749
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0044 0.1562 0.1562
Brugia malayi Nuclear hormone receptor E75 0.0016 0.0228 0.0228
Loa Loa (eye worm) nuclear hormone receptor 0.0016 0.0228 0.0228
Plasmodium vivax replication protein A1, large subunit, putative 0.004 0.1355 1
Brugia malayi ephrin receptor 1 precursor 0.0038 0.1266 0.1266
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.1072 0.1072
Schistosoma mansoni retinoic acid receptor RXR 0.0034 0.1072 0.2157
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.004 0.1355 0.3398
Onchocerca volvulus 0.0034 0.1072 0.1986
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0034 0.1072 0.1072
Loa Loa (eye worm) hypothetical protein 0.0018 0.0303 0.0303
Loa Loa (eye worm) hypothetical protein 0.0018 0.0318 0.0318
Echinococcus multilocularis nardilysin 0.0016 0.0237 0.0193
Trypanosoma brucei Replication factor A protein 1 0.004 0.1355 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0304 0.0304
Onchocerca volvulus 0.0016 0.0228 0.0422
Giardia lamblia Hypothetical protein 0.0018 0.0304 0.2454
Schistosoma mansoni thyroid hormone receptor 0.0034 0.1072 0.2157
Echinococcus granulosus Tolloid protein 1 0.0038 0.1288 0.1339
Trypanosoma cruzi peptidase, putative 0.0027 0.0736 0.1633
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0034 0.1072 0.1072
Echinococcus multilocularis insulin degrading enzyme 0.0027 0.0736 0.0726
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0053 0.196 0.2037
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0053 0.196 0.2037
Leishmania major lanosterol synthase, putative 0.002 0.0416 0.2765
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0016 0.0228 0.0183
Loa Loa (eye worm) hypothetical protein 0.0062 0.2412 0.2412
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0044 0.1562 0.1562
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0034 0.1072 0.1072
Loa Loa (eye worm) hypothetical protein 0.0016 0.0228 0.0228

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 21 nM BindingDB_Patents: Receptor Binding Assay. Human monocytic cell line THP-1 cells were obtained from American Type Culture Collection (Manassas, Va., USA). The THP-1 cells were grown in RPMI-1640 (RPMI: Roswell Park Memorial Institute Medium-cell culture growth media) supplemented with 10% fetal bovine serum in a humidified 5% CO2 atmosphere at 37° C. The cell density was maintained between 0.5×106 cells/mL. 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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