TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 327.379 | Formula: C21H17N3O
H donors: 2 H acceptors: 0 LogP: 4.2 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: NC(=N)c1ccc2c(c1)[nH]c(c2)c1ccc(cc1)Oc1ccccc1
InChi: 1S/C21H17N3O/c22-21(23)16-7-6-15-12-19(24-20(15)13-16)14-8-10-18(11-9-14)25-17-4-2-1-3-5-17/h1-13,24H,(H3,22,23)
InChiKey: UGBBYCQEWINEBH-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
Bacillus subtilis (strain 168)	KinA/Spo0F (sporulation kinase A/sporulation initiation phosphotransferase F)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium ulcerans	two component system membrane associated sensor kinase	Get druggable targets OG5_127115	All targets in OG5_127115
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	Get druggable targets OG5_127115	All targets in OG5_127115
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	Get druggable targets OG5_127115	All targets in OG5_127115
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	Get druggable targets OG5_127115	All targets in OG5_127115
Mycobacterium tuberculosis	Two component sensor histidine kinase PrrB	Get druggable targets OG5_127115	All targets in OG5_127115

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
Onchocerca volvulus		0.0392	0.289	1
Giardia lamblia	Cathepsin B precursor	0.0421	0.3161	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0392	0.289	0.2819
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0218	0.1231	0.1143
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Echinococcus granulosus	cathepsin L	0.0218	0.1231	0.1143
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Brugia malayi	cathepsin L-like precursor	0.0273	0.1759	0.1676
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0099	0.0099	0.0099
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0392	0.289	0.289
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0392	0.289	0.289
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0421	0.3161	0.3093
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0273	0.1759	0.1676
Brugia malayi	calpain family protein 1	0.012	0.03	0.0203
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0114	0.0246	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0218	0.1231	0.0323
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.114	1	1
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Trypanosoma cruzi	cysteine proteinase, putative	0.0218	0.1231	0.1143
Trypanosoma cruzi	cysteine proteinase, putative	0.0218	0.1231	0.1143
Mycobacterium ulcerans	two component system membrane associated sensor kinase	0.0099	0.01	0.5
Echinococcus multilocularis	cathepsin L cysteine protease	0.0392	0.289	0.289
Echinococcus granulosus	cathepsin b	0.114	1	1
Loa Loa (eye worm)	hypothetical protein	0.0171	0.0792	0.0792
Mycobacterium tuberculosis	Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog)	0.0211	0.1166	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Entamoeba histolytica	cysteine proteinase, putative	0.0218	0.1231	0.4054
Echinococcus granulosus	cathepsin l1	0.0273	0.1759	0.1676
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0211	0.1166	0.1078
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0099	0.0099	0.0099
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0218	0.1231	0.1143
Loa Loa (eye worm)	hypothetical protein	0.0119	0.0293	0.0293
Loa Loa (eye worm)	DEAH box polypeptide 35	0.049	0.3823	0.3823
Schistosoma mansoni	cathepsin F (C01 family)	0.0392	0.289	0.2819
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0392	0.289	0.9115
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Echinococcus granulosus	cathepsin b	0.114	1	1
Echinococcus multilocularis	cathepsin b	0.114	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0119	0.0293	0.0293
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	0.0099	0.01	0.5
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0211	0.1166	0.3485
Trypanosoma cruzi	cruzipain precursor, putative	0.0119	0.0293	0.0196
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0392	0.289	1
Entamoeba histolytica	DEAD/DEAH box helicase, putative	0.0211	0.1166	0.3823
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Echinococcus multilocularis	cysteine protease	0.0392	0.289	0.289
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0218	0.1231	0.3695
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0421	0.3161	1
Loa Loa (eye worm)	cysteine protease	0.0392	0.289	0.289
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Entamoeba histolytica	cysteine proteinase, putative	0.0218	0.1231	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0392	0.289	0.9115
Echinococcus multilocularis	cathepsin L	0.0099	0.0099	0.0099
Brugia malayi	Cathepsin L-like precursor	0.0119	0.0293	0.0196
Trypanosoma cruzi	cysteine peptidase, putative	0.0218	0.1231	0.1143
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1759	0.1759
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0421	0.3161	0.3093
Brugia malayi	Trypsin family protein	0.0171	0.0792	0.0699
Loa Loa (eye worm)	ctsf protein	0.0392	0.289	0.289
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0218	0.1231	0.0323
Entamoeba histolytica	cysteine proteinase 2	0.0218	0.1231	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Echinococcus multilocularis	cathepsin L cysteine protease	0.0392	0.289	0.289
Onchocerca volvulus		0.0392	0.289	1
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	0.0099	0.01	0.5
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1759	0.1759
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Onchocerca volvulus		0.0392	0.289	1
Brugia malayi	Papain family cysteine protease containing protein	0.0218	0.1231	0.1143
Treponema pallidum	ATP-dependent RNA helicase	0.0211	0.1166	0.5
Onchocerca volvulus		0.0273	0.1759	0.5946
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0211	0.1166	0.1078
Brugia malayi	Papain family cysteine protease containing protein	0.0392	0.289	0.2819
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0099	0.0099	0.0099
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0211	0.1166	0.3485
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0218	0.1231	0.1143
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.114	1	1
Echinococcus granulosus	cathepsin l1	0.0392	0.289	0.2819
Schistosoma mansoni	cathepsin F (C01 family)	0.0273	0.1759	0.1676
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0119	0.0293	0.0293
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0125	0.0352	0.0255
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Trypanosoma cruzi	cysteine peptidase, putative	0.0392	0.289	0.2819
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Brugia malayi	Papain family cysteine protease containing protein	0.0218	0.1231	0.1143
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Plasmodium vivax	vivapain-1	0.0218	0.1231	0.4054
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0119	0.0293	0.0196
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Trypanosoma cruzi	cysteine peptidase, putative	0.0392	0.289	0.2819
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0392	0.289	1
Echinococcus multilocularis	eukaryotic initiation factor 4A	0.0211	0.1166	0.1166
Leishmania major	cathepsin L-like protease	0.0392	0.289	0.8642
Toxoplasma gondii	eukaryotic initiation factor-4A, putative	0.0211	0.1166	0.3485
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0392	0.289	0.289
Leishmania major	cysteine peptidase A (CPA)	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0218	0.1231	0.1143
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0392	0.289	0.2819
Echinococcus granulosus	cysteine protease	0.0218	0.1231	0.1143
Trypanosoma cruzi	cruzipain precursor, putative	0.0392	0.289	0.2819
Loa Loa (eye worm)	fibroinase	0.0392	0.289	0.289
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.114	1	1
Onchocerca volvulus		0.0392	0.289	1
Brugia malayi	eukaryotic initiation factor 4A	0.0211	0.1166	0.1078
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1759	0.1759
Onchocerca volvulus	Cathepsin L homolog	0.0392	0.289	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.114	1	1
Schistosoma mansoni	cathepsin s	0.0119	0.0293	0.0196
Plasmodium vivax	RNA helicase-1, putative	0.0211	0.1166	0.3823
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Entamoeba histolytica	cysteine proteinase, putative	0.0273	0.1759	0.5946
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0211	0.1166	0.1078
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Schistosoma mansoni	cathepsin F (C01 family)	0.0392	0.289	0.2819
Brugia malayi	Cathepsin L-like precursor	0.0273	0.1759	0.1676
Onchocerca volvulus		0.0105	0.0164	0.0232
Trypanosoma cruzi	cysteine peptidase, putative	0.0392	0.289	0.2819
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0392	0.289	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Entamoeba histolytica	cysteine proteinase, putative	0.0218	0.1231	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.0119	0.0293	0.0196
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0211	0.1166	0.1078
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0392	0.289	1
Echinococcus granulosus	eukaryotic initiation factor 4A	0.0211	0.1166	0.1078
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0125	0.0352	0.0255
Brugia malayi	cathepsin F-like cysteine proteinase	0.0119	0.0293	0.0196
Echinococcus granulosus	calpain A	0.0125	0.0352	0.0255
Plasmodium vivax	unspecified product	0.0119	0.0293	0.0694
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.0125	0.0352	0.0352
Loa Loa (eye worm)	cathepsin B	0.0421	0.3161	0.3161
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.012	0.03	0.0203
Echinococcus multilocularis	cathepsin L	0.0218	0.1231	0.1231
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0171	0.0792	0.0699
Onchocerca volvulus	Eukaryotic initiation factor 4A homolog	0.0211	0.1166	0.3823
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Brugia malayi	calpain family protein 1	0.012	0.03	0.0203
Giardia lamblia	Translation initiation factor eIF-4A, putative	0.0211	0.1166	0.3485
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0211	0.1166	0.3485
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Onchocerca volvulus		0.0392	0.289	1
Echinococcus multilocularis	calpain A	0.0125	0.0352	0.0352
Onchocerca volvulus	Cathepsin L homolog	0.0392	0.289	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Echinococcus multilocularis	eukaryotic initiation factor 4A III	0.0211	0.1166	0.1166
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Plasmodium vivax	unspecified product	0.0218	0.1231	0.4054
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0273	0.1759	0.1676
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.0125	0.0352	0.0255
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0273	0.1759	0.542
Echinococcus multilocularis	cysteine protease	0.0392	0.289	0.289
Toxoplasma gondii	cathepsin B	0.0421	0.3161	1
Loa Loa (eye worm)	hypothetical protein	0.0392	0.289	0.289
Brugia malayi	Probable ATP-dependent helicase DHX35	0.049	0.3823	0.3761
Plasmodium vivax	vivapain-2	0.0392	0.289	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Giardia lamblia	Cathepsin B precursor	0.0421	0.3161	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0218	0.1231	0.4054
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0392	0.289	0.289
Entamoeba histolytica	cysteine proteinase, putative	0.0218	0.1231	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Plasmodium vivax	vivapain-2	0.0392	0.289	1
Plasmodium falciparum	eukaryotic initiation factor 4A	0.0211	0.1166	0.3823
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.114	1	1
Trypanosoma cruzi	cysteine protease, putative	0.0218	0.1231	0.1143
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0421	0.3161	1
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0171	0.0171
Giardia lamblia	Cathepsin B precursor	0.0421	0.3161	1
Loa Loa (eye worm)	hypothetical protein	0.0211	0.1166	0.1166
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Echinococcus granulosus	cathepsin L cysteine protease	0.0218	0.1231	0.1143
Onchocerca volvulus		0.0171	0.0792	0.2481
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0392	0.289	0.8642
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0421	0.3161	1
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Onchocerca volvulus		0.0392	0.289	1
Onchocerca volvulus		0.0392	0.289	1
Plasmodium vivax	vivapain-3	0.0218	0.1231	0.4054
Loa Loa (eye worm)	hypothetical protein	0.012	0.03	0.03
Echinococcus multilocularis	cathepsin b	0.114	1	1
Brugia malayi	Cathepsin L-like precursor	0.0392	0.289	0.2819
Loa Loa (eye worm)	hypothetical protein	0.0119	0.0293	0.0293
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0392	0.289	0.9115
Loa Loa (eye worm)	hypothetical protein	0.114	1	1
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0171	0.0792	0.0699
Toxoplasma gondii	cathepsin CPL	0.0392	0.289	0.9115
Entamoeba histolytica	cysteine protease, putative	0.0392	0.289	1
Entamoeba histolytica	cysteine proteinase, putative	0.0392	0.289	1
Loa Loa (eye worm)	hypothetical protein	0.049	0.3823	0.3823
Onchocerca volvulus	Cathepsin F homolog	0.0392	0.289	1
Loa Loa (eye worm)	calpain family protein 1	0.012	0.03	0.03
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0273	0.1759	0.542
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0099	0.0099
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0392	0.289	0.2819
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0218	0.1231	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0171	0.0792	0.0792
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0218	0.1231	0.3695
Brugia malayi	Cathepsin L-like precursor	0.0273	0.1759	0.1676
Echinococcus granulosus	eukaryotic initiation factor 4A III	0.0211	0.1166	0.1078
Entamoeba histolytica	cysteine proteinase 1, putative	0.0218	0.1231	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0392	0.289	0.9115

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.7 uM	Inhibition of KinA/Sp0F system two component (TCS) from Bacillus subtilis.	ChEMBL.	11412977
IC50 (binding)	= 7.7 uM	Inhibition of KinA/Sp0F system two component (TCS) from Bacillus subtilis.	ChEMBL.	11412977
MIC (functional)	= 4 ug ml-1	Inhibition of growth of Staphylococcus aureus ATCC 29213.	ChEMBL.	11412977
MIC (functional)	= 4 ug ml-1	Inhibition of growth of methicillin resistant Staphylococcus aureus MRSA OC 2089.	ChEMBL.	11412977
MIC (functional)	= 4 ug ml-1	Inhibition of growth of Enterococcus faecalis OC 3041.	ChEMBL.	11412977
MIC (functional)	= 4 ug ml-1	Inhibition of growth of Vancomycin resistant Enterococcus faecalis (VRE) OC 3312.	ChEMBL.	11412977

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: CHEMBL416972

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 55151