TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 227.667 | Formula: C9H6ClNO2S
H donors: 2 H acceptors: 2 LogP: 2.69 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: ONC(=O)c1cc2c(s1)c(Cl)ccc2
InChi: 1S/C9H6ClNO2S/c10-6-3-1-2-5-4-7(9(12)11-13)14-8(5)6/h1-4,13H,(H,11,12)
InChiKey: MVZZHBWPNLHHGQ-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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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	histone deacetylase 9	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium falciparum	histone deacetylase 2	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium berghei	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium falciparum	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Theileria parva	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus granulosus	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Loa Loa (eye worm)	histone deacetylase	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma cruzi	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium yoelii	Histone deacetylase family, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma brucei	histone deacetylase 4	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 4, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Toxoplasma gondii	histone deacetylase HDAC1	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma cruzi	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania major	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus granulosus	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma mansoni	histone deacetylase 4 5	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania braziliensis	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma mansoni	histone deacetylase 4 5	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium yoelii	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma congolense	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus multilocularis	histone deacetylase	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania infantum	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma congolense	histone deacetylase 4	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 10, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium vivax	histone deacetylase 2, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus multilocularis	histone deacetylase 7	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma mansoni	histone deacetylase hda2	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium vivax	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 4, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania mexicana	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus granulosus	histone deacetylase 7	Get druggable targets OG5_126654	All targets in OG5_126654
Neospora caninum	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania donovani	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Theileria parva	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Loa Loa (eye worm)	histone deacetylase 7A	Get druggable targets OG5_126654	All targets in OG5_126654
Theileria parva	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Cryptosporidium hominis	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium knowlesi	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma cruzi	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 6, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	IPR000286,Histone deacetylase superfamily;IPR013838,Beta tubulin, autoregulation binding site,domain-containing	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus multilocularis	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma brucei gambiense	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 10, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania braziliensis	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus granulosus	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Brugia malayi	Histone deacetylase family protein	Get druggable targets OG5_126654	All targets in OG5_126654
Candida albicans	strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit	Get druggable targets OG5_126654	All targets in OG5_126654
Candida albicans	strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma brucei	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium knowlesi	histone deacetylase 2, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania mexicana	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Schistosoma japonicum	Histone deacetylase 6, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus granulosus	histone deacetylase	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania donovani	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Echinococcus multilocularis	histone deacetylase 6	Get druggable targets OG5_126654	All targets in OG5_126654
Plasmodium berghei	histone deacetylase 2, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania infantum	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma congolense	histone deacetylase 4	Get druggable targets OG5_126654	All targets in OG5_126654
Babesia bovis	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Trypanosoma brucei	histone deacetylase 3	Get druggable targets OG5_126654	All targets in OG5_126654
Brugia malayi	Histone deacetylase family protein	Get druggable targets OG5_126654	All targets in OG5_126654
Leishmania major	histone deacetylase, putative	Get druggable targets OG5_126654	All targets in OG5_126654
Cryptosporidium parvum	histone deactylase of possible bacterial origin with ankyrin repeats at the N-terminus	Get druggable targets OG5_126654	All targets in OG5_126654

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	cathepsin b	0.0326	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0061	0.0351	0.0351
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0326	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0061	0.0351	0.1403
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0912	0.0912
Echinococcus multilocularis	cathepsin L	0.0061	0.0351	0.0351
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0109	0.2115	0.2115
Plasmodium vivax	unspecified product	0.0061	0.0351	0.1661
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Giardia lamblia	Cathepsin B precursor	0.012	0.2505	0.5
Brugia malayi	Papain family cysteine protease containing protein	0.0109	0.2115	0.2115
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.012	0.2505	0.2505
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0076	0.0912	0.2606
Leishmania major	cysteine peptidase A (CPA)	0.0109	0.2115	0.8443
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0326	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0061	0.0351	0.0351
Trypanosoma cruzi	cruzipain precursor, putative	0.0109	0.2115	0.2115
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0326	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Echinococcus multilocularis	cathepsin L cysteine protease	0.0109	0.2115	0.2115
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Trypanosoma cruzi	cysteine peptidase, putative	0.0109	0.2115	0.2115
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Echinococcus multilocularis	cathepsin L cysteine protease	0.0109	0.2115	0.2115
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0061	0.0351	0.0351
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Plasmodium vivax	vivapain-3	0.0061	0.0351	0.1661
Brugia malayi	Papain family cysteine protease containing protein	0.0061	0.0351	0.0351
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.012	0.2505	0.2505
Brugia malayi	cathepsin L-like precursor	0.0076	0.0912	0.0912
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0061	0.0351	0.1661
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Onchocerca volvulus		0.0109	0.2115	1
Echinococcus multilocularis	cysteine protease	0.0109	0.2115	0.2115
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Onchocerca volvulus	Cathepsin L homolog	0.0109	0.2115	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0109	0.2115	0.2115
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0109	0.2115	0.2115
Echinococcus granulosus	cathepsin l1	0.0076	0.0912	0.0912
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Entamoeba histolytica	cysteine proteinase, putative	0.0109	0.2115	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Brugia malayi	Cathepsin L-like precursor	0.0076	0.0912	0.0912
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0076	0.0912	0.0912
Entamoeba histolytica	cysteine protease, putative	0.0109	0.2115	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0109	0.2115	1
Toxoplasma gondii	cathepsin B	0.012	0.2505	1
Onchocerca volvulus		0.0109	0.2115	1
Loa Loa (eye worm)	fibroinase	0.0109	0.2115	0.2115
Loa Loa (eye worm)	cysteine protease	0.0109	0.2115	0.2115
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0109	0.2115	0.2115
Schistosoma mansoni	cathepsin F (C01 family)	0.0109	0.2115	0.2115
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0076	0.0912	0.0912
Echinococcus granulosus	cysteine protease	0.0061	0.0351	0.0351
Onchocerca volvulus		0.0109	0.2115	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.012	0.2505	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0076	0.0912	0.0912
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0326	1	1
Trypanosoma cruzi	cysteine protease, putative	0.0061	0.0351	0.0351
Loa Loa (eye worm)	hypothetical protein	0.0326	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0326	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0076	0.0912	0.2606
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Entamoeba histolytica	cysteine proteinase, putative	0.0109	0.2115	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Plasmodium vivax	vivapain-1	0.0061	0.0351	0.1661
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0061	0.0351	0.0351
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0109	0.2115	0.8189
Echinococcus multilocularis	cathepsin b	0.0326	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Onchocerca volvulus	Cathepsin F homolog	0.0109	0.2115	1
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Echinococcus multilocularis	cathepsin b	0.0326	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0109	0.2115	0.2115
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Plasmodium vivax	vivapain-2	0.0109	0.2115	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0061	0.0351	0.0351
Loa Loa (eye worm)	ctsf protein	0.0109	0.2115	0.2115
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0061	0.0351	0.0351
Echinococcus multilocularis	cysteine protease	0.0109	0.2115	0.2115
Giardia lamblia	Cathepsin B precursor	0.012	0.2505	0.5
Echinococcus granulosus	cathepsin l1	0.0109	0.2115	0.2115
Onchocerca volvulus		0.0109	0.2115	1
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Onchocerca volvulus		0.0109	0.2115	1
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Loa Loa (eye worm)	hypothetical protein	0.0109	0.2115	0.2115
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0061	0.0351	0.0351
Loa Loa (eye worm)	cathepsin B	0.012	0.2505	0.2505
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0061	0.0351	0.1403
Toxoplasma gondii	cathepsin CPL	0.0109	0.2115	0.8443
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0109	0.2115	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0061	0.0351	0.0351
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Entamoeba histolytica	cysteine proteinase, putative	0.0076	0.0912	0.3182
Onchocerca volvulus		0.0109	0.2115	1
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0912	0.0912
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.012	0.2505	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0109	0.2115	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0109	0.2115	0.2115
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma cruzi	cysteine proteinase, putative	0.0061	0.0351	0.0351
Echinococcus granulosus	cathepsin b	0.0326	1	1
Onchocerca volvulus		0.0109	0.2115	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0109	0.2115	0.8189
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0109	0.2115	0.8443
Trypanosoma cruzi	cysteine peptidase, putative	0.0109	0.2115	0.2115
Trypanosoma cruzi	cysteine peptidase, putative	0.0109	0.2115	0.2115
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0109	0.2115	0.2115
Brugia malayi	Cathepsin L-like precursor	0.0109	0.2115	0.2115
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0912	0.0912
Brugia malayi	Cathepsin L-like precursor	0.0076	0.0912	0.0912
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Giardia lamblia	Cathepsin B precursor	0.012	0.2505	0.5
Leishmania major	cathepsin L-like protease	0.0109	0.2115	0.8443
Onchocerca volvulus	Cathepsin L homolog	0.0109	0.2115	1
Plasmodium vivax	vivapain-2	0.0109	0.2115	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0109	0.2115	0.2115
Echinococcus granulosus	cathepsin L	0.0061	0.0351	0.0351
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0109	0.2115	0.8189
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.012	0.2505	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2.91 uM	Inhibition of HDAC in human HeLa cells assessed as deacetylation of substrate by fluorescence plate reader analysis	ChEMBL.	23768910

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

ChEMBL: CHEMBL2403446

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1778846