Detailed information for compound 1730147

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 583.717 | Formula: C35H41N3O5
  • H donors: 3 H acceptors: 4 LogP: 6.27 Rotable bonds: 16
    Rule of 5 violations (Lipinski): 2
  • SMILES: CC[C@@H]([C@@H]1C(=O)O[C@H]1C(=O)N[C@H]1C[C@H]1C[C@H](NC(=O)[C@@H](NC(=O)c1ccc2c(c1)cccc2)C)CCc1ccccc1)C
  • InChi: 1S/C35H41N3O5/c1-4-21(2)30-31(43-35(30)42)34(41)38-29-20-27(29)19-28(17-14-23-10-6-5-7-11-23)37-32(39)22(3)36-33(40)26-16-15-24-12-8-9-13-25(24)18-26/h5-13,15-16,18,21-22,27-31H,4,14,17,19-20H2,1-3H3,(H,36,40)(H,37,39)(H,38,41)/t21-,22-,27+,28+,29-,30-,31+/m0/s1
  • InChiKey: FSOVGOMXHCXPCB-PABBUDNQSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens proteasome (prosome, macropain) subunit, beta type, 5 Starlite/ChEMBL References
Homo sapiens proteasome (prosome, macropain) subunit, beta type, 1 Starlite/ChEMBL References
Homo sapiens proteasome (prosome, macropain) subunit, beta type, 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania donovani proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma brucei proteasome beta 6 subunit Get druggable targets OG5_127834 All targets in OG5_127834
Candida albicans proteasome subunit Get druggable targets OG5_127834 All targets in OG5_127834
Leishmania mexicana proteasome beta 5 subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Brugia malayi proteasome subunit beta type 2 Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania mexicana proteasome beta 2 subunit, putative Get druggable targets OG5_127700 All targets in OG5_127700
Entamoeba histolytica proteasome subunit beta type 1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Plasmodium vivax proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma cruzi proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Trypanosoma cruzi proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Schistosoma japonicum ko:K02732 20S proteasome subunit beta 6, putative Get druggable targets OG5_127834 All targets in OG5_127834
Leishmania mexicana proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Plasmodium yoelii proteasome subunit beta type 1-related Get druggable targets OG5_127834 All targets in OG5_127834
Trypanosoma brucei proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Trypanosoma cruzi proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Schistosoma mansoni proteasome subunit beta 1 (T01 family) Get druggable targets OG5_127834 All targets in OG5_127834
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase Get druggable targets OG5_127834 All targets in OG5_127834
Plasmodium knowlesi proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Schistosoma japonicum ko:K02737 20S proteasome subunit beta 5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Plasmodium vivax proteasome subunit beta type-1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Mycobacterium tuberculosis Proteasome beta subunit PrcB; assembles with alpha subunit PrcA. Get druggable targets OG5_127100 All targets in OG5_127100
Giardia lamblia Proteasome subunit beta type 2 Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma congolense proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Candida albicans endopeptidase required for mitosis and sporulation Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma brucei proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium knowlesi proteasome subunit beta type-1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Theileria parva proteasome subunit beta type 5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Echinococcus granulosus proteasome prosome macropain subunit beta Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma cruzi 20S proteasome subunit Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania braziliensis proteasome beta 5 subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Leishmania infantum proteasome beta 2 subunit, putative Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium berghei proteasome subunit beta type-1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Leishmania infantum proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Neospora caninum Proteasome (Prosome, macropain) subunit, beta type, 1, related Get druggable targets OG5_127700 All targets in OG5_127700
Echinococcus granulosus proteasome prosome macropain Get druggable targets OG5_127100 All targets in OG5_127100
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase Get druggable targets OG5_127100 All targets in OG5_127100
Babesia bovis proteasome epsilon subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Leishmania donovani proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Trypanosoma congolense proteasome beta 6 subunit Get druggable targets OG5_127834 All targets in OG5_127834
Theileria parva proteasome subunit beta type 2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania major proteasome beta 2 subunit, putative Get druggable targets OG5_127700 All targets in OG5_127700
Loa Loa (eye worm) proteasome subunit beta type 1 Get druggable targets OG5_127834 All targets in OG5_127834
Mycobacterium ulcerans proteasome PrcB Get druggable targets OG5_127100 All targets in OG5_127100
Neospora caninum hypothetical protein Get druggable targets OG5_127834 All targets in OG5_127834
Brugia malayi proteasome subunit beta type 1 Get druggable targets OG5_127834 All targets in OG5_127834
Mycobacterium leprae proteasome (beta subunit) PrcB Get druggable targets OG5_127100 All targets in OG5_127100
Trypanosoma brucei gambiense proteasome beta 5 subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Schistosoma mansoni proteasome subunit beta 2 (T01 family) Get druggable targets OG5_127700 All targets in OG5_127700
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase Get druggable targets OG5_127700 All targets in OG5_127700
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_127100 All targets in OG5_127100
Babesia bovis proteasome beta 2 subunit, putative Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium falciparum proteasome subunit beta type-1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Giardia lamblia Proteasome subunit beta type 1 Get druggable targets OG5_127834 All targets in OG5_127834
Candida albicans proteasome subunit Get druggable targets OG5_127100 All targets in OG5_127100
Echinococcus granulosus proteasome prosome macropain subunit beta Get druggable targets OG5_127834 All targets in OG5_127834
Schistosoma mansoni proteasome subunit beta 2 (T01 family) Get druggable targets OG5_127700 All targets in OG5_127700
Candida albicans proteasome subunit Get druggable targets OG5_127100 All targets in OG5_127100
Entamoeba histolytica proteasome subunit beta type 5 precursor, putative Get druggable targets OG5_127100 All targets in OG5_127100
Plasmodium berghei proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania braziliensis proteasome beta 2 subunit, putative Get druggable targets OG5_127700 All targets in OG5_127700
Theileria parva proteasome beat subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Trypanosoma brucei gambiense proteasome beta 2 subunit, putative,20S proteasome subunit Get druggable targets OG5_127700 All targets in OG5_127700
Cryptosporidium parvum 20S proteasome beta subunit D2 (PBD2) , putative Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma cruzi proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Cryptosporidium hominis 20S proteasome beta subunit D2 (PBD2) Get druggable targets OG5_127700 All targets in OG5_127700
Trypanosoma cruzi proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Loa Loa (eye worm) proteasome subunit beta type 2 Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium vivax proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Trypanosoma brucei gambiense proteasome beta 6 subunit,20S proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Giardia lamblia Proteasome subunit beta type 5 precursor Get druggable targets OG5_127100 All targets in OG5_127100
Loa Loa (eye worm) proteasome A-type and B-type family protein Get druggable targets OG5_127100 All targets in OG5_127100
Toxoplasma gondii proteasome subunit beta type 2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium knowlesi proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Toxoplasma gondii proteasome subunit beta type, putative Get druggable targets OG5_127100 All targets in OG5_127100
Plasmodium falciparum proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Neospora caninum Family T1, proteasome beta subunit, threonine peptidase, related Get druggable targets OG5_127100 All targets in OG5_127100
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta Get druggable targets OG5_127834 All targets in OG5_127834
Entamoeba histolytica probable proteasome subunit beta type 2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Toxoplasma gondii proteasome subunit beta type 1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Cryptosporidium parvum proteasome subunit beta type 1, putative Get druggable targets OG5_127834 All targets in OG5_127834
Brugia malayi Proteasome A-type and B-type family protein Get druggable targets OG5_127100 All targets in OG5_127100
Leishmania donovani proteasome subunit beta type-5, putative Get druggable targets OG5_127100 All targets in OG5_127100
Leishmania braziliensis proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Candida albicans endopeptidase required for mitosis and sporulation Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania major proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative Get druggable targets OG5_127834 All targets in OG5_127834
Schistosoma mansoni proteasome catalytic subunit 3 (T01 family) Get druggable targets OG5_127100 All targets in OG5_127100
Plasmodium yoelii proteasome subunit beta type 2 Get druggable targets OG5_127700 All targets in OG5_127700
Candida albicans proteasome subunit Get druggable targets OG5_127834 All targets in OG5_127834
Babesia bovis proteasome A-type and B-type family protein Get druggable targets OG5_127834 All targets in OG5_127834
Plasmodium yoelii proteosome PSMB5/8 protein Get druggable targets OG5_127100 All targets in OG5_127100
Trypanosoma congolense proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Schistosoma japonicum ko:K02734 20S proteasome subunit beta 4, putative Get druggable targets OG5_127700 All targets in OG5_127700
Plasmodium berghei proteasome subunit beta type-2, putative Get druggable targets OG5_127700 All targets in OG5_127700
Leishmania infantum proteasome beta 5 subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Plasmodium falciparum proteasome subunit beta type-5 Get druggable targets OG5_127100 All targets in OG5_127100
Cryptosporidium parvum Pre2p/proteasome subunit beta type 5; NTN hydrolase fold Get druggable targets OG5_127100 All targets in OG5_127100
Cryptosporidium hominis proteasome subunit beta type 1 (20S proteasome alpha subunit F) (20S proteasome subunit beta-6) Get druggable targets OG5_127834 All targets in OG5_127834
Leishmania major proteasome beta 5 subunit, putative Get druggable targets OG5_127100 All targets in OG5_127100
Echinococcus multilocularis proteasome (prosome, macropain) Get druggable targets OG5_127100 All targets in OG5_127100
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase Get druggable targets OG5_127700 All targets in OG5_127700
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum proteasome subunit alpha type-5, putative proteasome (prosome, macropain) subunit, beta type, 5 160 aa 148 aa 23.0 %
Plasmodium falciparum proteasome subunit beta type-5 proteasome (prosome, macropain) subunit, beta type, 1 241 aa 194 aa 27.3 %
Trypanosoma brucei proteasome alpha 3 subunit, putative proteasome (prosome, macropain) subunit, beta type, 2 176 aa 146 aa 26.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0343 0.3176 1
Onchocerca volvulus 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Echinococcus multilocularis cysteine protease 0.0343 0.3176 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Schistosoma mansoni cathepsin F (C01 family) 0.023 0.17 0.5353
Plasmodium falciparum cysteine proteinase falcipain 1 0.0177 0.1011 0.3184
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.023 0.17 0.5353
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.023 0.17 0.5353
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Entamoeba histolytica cysteine proteinase, putative 0.0177 0.1011 0.3184
Entamoeba histolytica cysteine proteinase 1, putative 0.0177 0.1011 0.3184
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0113 0.0187 0.0589
Onchocerca volvulus Cathepsin L homolog 0.0343 0.3176 1
Echinococcus granulosus cathepsin l1 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0177 0.1011 0.3184
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0177 0.1011 0.1011
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0343 0.3176 1
Brugia malayi Papain family cysteine protease containing protein 0.0343 0.3176 1
Leishmania major cathepsin L-like protease 0.0343 0.3176 0.3176
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine proteinase, putative 0.0177 0.1011 0.3184
Entamoeba histolytica cysteine proteinase, putative 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Brugia malayi Papain family cysteine protease containing protein 0.0177 0.1011 0.3184
Trypanosoma cruzi cysteine peptidase, putative 0.0343 0.3176 0.3176
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Trypanosoma cruzi cysteine peptidase, putative 0.0113 0.0187 0.0187
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Loa Loa (eye worm) hypothetical protein 0.023 0.17 0.5353
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0343 0.3176 1
Brugia malayi cathepsin F-like cysteine proteinase 0.0113 0.0187 0.0589
Loa Loa (eye worm) hypothetical protein 0.0343 0.3176 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0343 0.3176 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0177 0.1011 0.1011
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0177 0.1011 0.1011
Plasmodium vivax vivapain-1 0.0177 0.1011 0.3184
Loa Loa (eye worm) hypothetical protein 0.0113 0.0187 0.0589
Echinococcus multilocularis cysteine protease 0.0343 0.3176 1
Echinococcus granulosus cysteine protease 0.0177 0.1011 0.3184
Echinococcus multilocularis cathepsin L 0.0177 0.1011 0.3184
Onchocerca volvulus Cathepsin F homolog 0.0343 0.3176 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0143 0.057 0.1794
Onchocerca volvulus Cathepsin L homolog 0.0343 0.3176 1
Entamoeba histolytica cysteine proteinase, putative 0.0343 0.3176 1
Entamoeba histolytica cysteine proteinase, putative 0.0177 0.1011 0.3184
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0343 0.3176 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0177 0.1011 0.3184
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0143 0.057 0.1794
Entamoeba histolytica hypothetical protein 0.0143 0.057 0.1794
Plasmodium vivax vivapain-3 0.0177 0.1011 0.3184
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0177 0.1011 0.3184
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0755 0.8524 0.8524
Plasmodium vivax unspecified product 0.0177 0.1011 0.3184
Echinococcus granulosus cathepsin L cysteine proteinase 0.0343 0.3176 1
Onchocerca volvulus 0.0343 0.3176 1
Leishmania major cathepsin L-like protease 0.0343 0.3176 0.3176
Entamoeba histolytica cysteine proteinase, putative 0.023 0.17 0.5353
Trypanosoma cruzi cysteine proteinase, putative 0.0177 0.1011 0.1011
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Echinococcus multilocularis cathepsin L cysteine protease 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Loa Loa (eye worm) hypothetical protein 0.0113 0.0187 0.0589
Schistosoma mansoni transcription factor LCR-F1 0.0143 0.057 0.1794
Entamoeba histolytica hypothetical protein 0.0143 0.057 0.1794
Entamoeba histolytica hypothetical protein 0.0143 0.057 0.1794
Toxoplasma gondii cathepsin CPL 0.0343 0.3176 1
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Leishmania major cathepsin L-like protease 0.0343 0.3176 0.3176
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Loa Loa (eye worm) fibroinase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Echinococcus granulosus cathepsin L 0.0177 0.1011 0.3184
Onchocerca volvulus 0.0343 0.3176 1
Brugia malayi cathepsin L-like precursor 0.023 0.17 0.5353
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Trypanosoma cruzi cysteine proteinase, putative 0.0177 0.1011 0.1011
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0343 0.3176 1
Schistosoma mansoni hypothetical protein 0.0143 0.057 0.1794
Onchocerca volvulus 0.0343 0.3176 1
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Leishmania major cathepsin L-like protease 0.0343 0.3176 0.3176
Plasmodium falciparum cysteine proteinase falcipain 3 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Onchocerca volvulus 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0343 0.3176 1
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Trypanosoma cruzi major cysteine proteinase, putative 0.0588 0.636 0.636
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Loa Loa (eye worm) cysteine protease 0.0343 0.3176 1
Loa Loa (eye worm) hypothetical protein 0.0113 0.0187 0.0589
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Plasmodium vivax vivapain-2 0.0343 0.3176 1
Trypanosoma cruzi cruzipain precursor, putative 0.0113 0.0187 0.0187
Schistosoma mansoni cathepsin s 0.0113 0.0187 0.0589
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica hypothetical protein 0.0143 0.057 0.1794
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Brugia malayi Cathepsin L-like precursor 0.023 0.17 0.5353
Echinococcus granulosus cathepsin L cysteine protease 0.0177 0.1011 0.3184
Trypanosoma cruzi cysteine peptidase, putative 0.0177 0.1011 0.1011
Brugia malayi hypothetical protein 0.0143 0.057 0.1794
Brugia malayi Cathepsin L-like precursor 0.0113 0.0187 0.0589
Leishmania major cysteine peptidase A (CPA) 0.0343 0.3176 0.3176
Trypanosoma cruzi cysteine protease, putative 0.0177 0.1011 0.1011
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Schistosoma mansoni cathepsin F (C01 family) 0.0343 0.3176 1
Loa Loa (eye worm) hypothetical protein 0.023 0.17 0.5353
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0113 0.0187 0.0589
Brugia malayi Papain family cysteine protease containing protein 0.0177 0.1011 0.3184
Onchocerca volvulus 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.023 0.17 0.5353
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0177 0.1011 0.3184
Onchocerca volvulus 0.0343 0.3176 1
Echinococcus granulosus cathepsin l1 0.023 0.17 0.5353
Entamoeba histolytica cysteine proteinase 2 0.0177 0.1011 0.3184
Loa Loa (eye worm) ctsf protein 0.0343 0.3176 1
Brugia malayi Cathepsin L-like precursor 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Brugia malayi Cathepsin L-like precursor 0.023 0.17 0.5353
Leishmania major cathepsin L-like protease 0.0343 0.3176 0.3176
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Schistosoma mansoni cathepsin F (C01 family) 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0177 0.1011 0.3184
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0343 0.3176 1
Plasmodium vivax vivapain-2 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Loa Loa (eye worm) hypothetical protein 0.023 0.17 0.5353
Entamoeba histolytica cysteine proteinase, putative 0.0177 0.1011 0.3184
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0343 0.3176 1
Entamoeba histolytica cysteine protease, putative 0.0177 0.1011 0.3184
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0343 0.3176 1
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0343 0.3176 1
Plasmodium vivax unspecified product 0.0113 0.0187 0.0589

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 10 nM Inhibition of chymotrypsin-like activity of human 20S proteasome beta 5 subunit using Suc-LLVY-AMC as substrate after 60 mins by fluorescence assay ChEMBL. 23547757
IC50 (binding) > 3000 nM Inhibition of trypsin-like activity of human 20S proteasome beta 2 subunit using Ac-RLR-AMC as substrate after 60 mins by fluorescence assay ChEMBL. 23547757
IC50 (binding) > 3000 nM Inhibition of caspase-like activity of human 20S proteasome beta 1 subunit using Ac-nLPnLD-AMC as substrate after 60 mins by fluorescence assay ChEMBL. 23547757
IC50 (functional) = 0.79 uM Cytotoxicity against human HCT116 cells after 72 hrs by CCK-8 assay ChEMBL. 23547757

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 23547757

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.

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