TDR Targets

Basic information

Technical information

TDR Targets ID: 1860029
Name: [[4-[5-(4-chlorophenyl)triazol-1-yl]phenyl]me thylideneamino]thiourea
MW: 356.833 | Formula: C16H13ClN6S
H donors: 2 H acceptors: 2 LogP: 2.92 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: NC(=S)N/N=C/c1ccc(cc1)n1nncc1c1ccc(cc1)Cl
InChi: 1S/C16H13ClN6S/c17-13-5-3-12(4-6-13)15-10-20-22-23(15)14-7-1-11(2-8-14)9-19-21-16(18)24/h1-10H,(H3,18,21,24)/b19-9+
InChiKey: WSYQKUDHDNWNRD-DJKKODMXSA-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

[[4-[5-(4-chlorophenyl)triazol-1-yl]phenyl]methyleneamino]thiourea
[[4-[5-(4-chlorophenyl)-1-triazolyl]phenyl]methyleneamino]thiourea
[[4-[5-(4-chlorophenyl)triazol-1-yl]benzylidene]amino]thiourea
[[4-[5-(4-chlorophenyl)-1,2,3-triazol-1-yl]phenyl]methylideneamino]thiourea
T0505-1753

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	APEX nuclease (multifunctional DNA repair enzyme) 1	Starlite/ChEMBL	No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed) iota	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10771 AP endonuclease 1, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Toxoplasma gondii	exonuclease III APE	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania infantum	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium yoelii	putative AP endonuclease-related	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Trypanosoma congolense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium parvum	conserved hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania mexicana	apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei gambiense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Plasmodium knowlesi	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10772 AP endonuclease 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Entamoeba histolytica	exodeoxyribonuclease III, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium hominis	dna-(apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium berghei	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania braziliensis	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi	exonuclease III	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Theileria parva	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania donovani	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Treponema pallidum	exodeoxyribonuclease (exoA)	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768

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
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0023	0.2628	0.9683
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0023	0.2714	1
Echinococcus granulosus	FTZ F1 alpha	0.0012	0.1105	0.2376
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.2714	1
Toxoplasma gondii	exonuclease III APE	0.0023	0.2628	0.2966
Schistosoma mansoni	zinc finger protein	0.0006	0.017	0.017
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Trypanosoma brucei	DNA damage repair protein, putative	0.0007	0.0384	0.1415
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0012	0.1105	0.2532
Trypanosoma brucei	unspecified product	0.0016	0.1665	0.6136
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Trypanosoma cruzi	DNA polymerase eta, putative	0.0007	0.0384	0.1415
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0012	0.1105	0.1105
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1665	0.6136
Loa Loa (eye worm)	hypothetical protein	0.0006	0.027	0.0619
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.1105	0.2532
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Trypanosoma brucei	unspecified product	0.0016	0.1665	0.6136
Loa Loa (eye worm)	hypothetical protein	0.0023	0.2714	0.622
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0006	0.017	0.017
Schistosoma mansoni	DNA polymerase IV / kappa	0.0007	0.0384	0.0384
Brugia malayi	tailless protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.027	0.0619
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0012	0.1105	0.2532
Brugia malayi	nuclear hormone receptor family member odr-7	0.0006	0.017	0.0389
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.1105	0.2532
Echinococcus multilocularis	dna polymerase eta	0.0023	0.2714	0.5837
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Brugia malayi	nuclear receptor NHR-88	0.0006	0.017	0.0389
Giardia lamblia	DNA damage repair protein	0.0007	0.0384	0.1415
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Schistosoma mansoni	RAR-like nuclear receptor	0.0012	0.1105	0.1105
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0023	0.2628	0.5651
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0.2628	0.5
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0012	0.1105	0.2376
Trypanosoma brucei	hypothetical protein, conserved	0.0007	0.0384	0.1415
Brugia malayi	nuclear receptor RXR	0.0006	0.027	0.0619
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0012	0.1105	0.1105
Schistosoma mansoni	nuclear receptor nhr-48	0.0006	0.017	0.017
Loa Loa (eye worm)	nuclear hormone receptor	0.0006	0.017	0.0389
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.8861	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.1105	0.2376
Schistosoma mansoni	nuclear receptor	0.0006	0.017	0.017
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.2628	0.9683
Onchocerca volvulus		0.0006	0.017	0.0389
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0012	0.1105	0.2532
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.1105	0.2532
Loa Loa (eye worm)	steroid hormone receptor	0.0012	0.1105	0.2532
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Trypanosoma brucei	hypothetical protein, conserved	0.0007	0.0384	0.1415
Echinococcus granulosus	nuclear receptor nhr 48	0.0006	0.017	0.0365
Trypanosoma cruzi	hypothetical protein, conserved	0.0007	0.0384	0.1415
Schistosoma mansoni	nuclear receptor	0.0006	0.017	0.017
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.2714	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0006	0.017	0.0365
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Brugia malayi	ecdysone receptor	0.0006	0.017	0.0389
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.2628	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0012	0.1105	0.2532
Toxoplasma gondii	BRCA1 C Terminus (BRCT) domain-containing protein	0.0007	0.0384	0.0433
Echinococcus multilocularis	nuclear receptor nhr 48	0.0006	0.017	0.0365
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0012	0.1105	0.2376
Brugia malayi	hypothetical protein	0.0006	0.027	0.0619
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0023	0.2628	0.9683
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0012	0.1105	0.2532
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0891	0.1916
Trypanosoma cruzi	hypothetical protein, conserved	0.0007	0.0384	0.1415
Schistosoma mansoni	cpg binding protein	0.0035	0.4363	0.4363
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1665	0.6136
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.2714	0.622
Leishmania major	DNA polymerase kappa, putative	0.0023	0.2714	1
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0023	0.2714	0.2714
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.0474	0.1748
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0023	0.2628	0.9683
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0007	0.0384	0.0433
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0006	0.027	0.0619
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0006	0.017	0.0389
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0012	0.1105	0.2532
Brugia malayi	nuclear hormone receptor	0.0012	0.1105	0.2532
Loa Loa (eye worm)	hypothetical protein	0.0006	0.027	0.0619
Trypanosoma brucei	DNA polymerase eta, putative	0.0023	0.2714	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0023	0.2628	0.5651
Schistosoma mansoni	ap endonuclease	0.0023	0.2628	0.2628
Schistosoma mansoni	retinoic acid receptor RXR	0.0012	0.1105	0.1105
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0891	0.2042
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.2714	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0012	0.1105	0.1105
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0006	0.027	0.0581
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0023	0.2628	0.9683
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Echinococcus granulosus	ecdysone induced protein 78C	0.0012	0.1105	0.2376
Plasmodium vivax	DNA repair protein REV1, putative	0.0007	0.0384	0.1461
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0012	0.1105	0.2376
Schistosoma mansoni	nuclear hormone receptor	0.0012	0.1105	0.1105
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0006	0.017	0.0365
Onchocerca volvulus		0.0012	0.1105	0.2532
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0023	0.2628	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0012	0.1105	0.1105
Loa Loa (eye worm)	DR-78	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Brugia malayi	hypothetical protein	0.0006	0.017	0.0389
Brugia malayi	CXXC zinc finger family protein	0.0035	0.4363	1
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0009	0.0584	0.1257
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0006	0.017	0.0365
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0006	0.017	0.017
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.4363	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0012	0.1105	0.1105
Brugia malayi	Nuclear hormone receptor E75	0.0006	0.017	0.0389
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0023	0.2628	0.6023
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0023	0.2628	0.9683
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0012	0.1105	0.2376
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0023	0.2628	0.9683
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0005	0.0056	0.0056
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0006	0.017	0.0365
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.0474	0.1748
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.1105	0.1105
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0006	0.017	0.0389
Trypanosoma brucei	unspecified product	0.0023	0.2714	1
Echinococcus granulosus	dna polymerase eta	0.0023	0.2714	0.5837
Brugia malayi	ecdysteroid receptor	0.0012	0.1105	0.2532
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0384	0.088
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0584	0.0584
Brugia malayi	photoreceptor-specific nuclear receptor	0.0012	0.1105	0.2532
Schistosoma mansoni	ap endonuclease	0.0023	0.2628	0.2628
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0023	0.2714	1
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0007	0.0384	0.0433
Brugia malayi	nuclear receptor RXR	0.0006	0.017	0.0389
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.027	0.0619
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0006	0.017	0.0389
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0023	0.2714	0.5837
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0891	0.1916
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.2714	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0012	0.1105	0.2532
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.1105	0.2532
Schistosoma mansoni	nuclear hormone receptor	0.0006	0.017	0.017
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0006	0.027	0.027
Leishmania major	DNA polymerase eta, putative	0.0007	0.0384	0.1415
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0871	0.1996
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0006	0.027	0.0581
Trypanosoma brucei	DNA polymerase kappa, putative	0.0007	0.0384	0.1415
Brugia malayi	exodeoxyribonuclease III family protein	0.0023	0.2628	0.6023
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0584	0.1257
Schistosoma mansoni	coup transcription factor	0.0012	0.1105	0.1105
Brugia malayi	conserved hypotetical protein	0.0006	0.017	0.0389
Brugia malayi	nuclear receptor NHR-88	0.0012	0.1105	0.2532
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Echinococcus multilocularis	cpg binding protein	0.0037	0.465	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.027	0.0619
Trichomonas vaginalis	DNA polymerase eta, putative	0.0023	0.2714	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0006	0.017	0.0365
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0012	0.1105	0.2376
Brugia malayi	orphan nuclear receptor NR2E1	0.0006	0.017	0.0389
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.1105	0.2532
Giardia lamblia	DINP protein human, muc B family	0.0023	0.2714	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Onchocerca volvulus		0.0035	0.4363	1
Echinococcus granulosus	dna polymerase kappa	0.0023	0.2714	0.5837
Loa Loa (eye worm)	hypothetical protein	0.0006	0.027	0.0619
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.1105	0.2376
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.2714	1
Trichomonas vaginalis	helicase, putative	0.0008	0.0474	0.1748
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.1105	0.1105
Echinococcus granulosus	cpg binding protein	0.0037	0.465	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.0012	0.1105	0.2532
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.1105	0.2376
Trypanosoma brucei	DNA polymerase kappa, putative	0.0007	0.0384	0.1415
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0012	0.1105	0.2532
Brugia malayi	hypothetical protein	0.0006	0.017	0.0389
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0023	0.2628	0.963
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Schistosoma mansoni	cpg binding protein	0.0037	0.465	0.465
Onchocerca volvulus	Bile acid receptor homolog	0.0012	0.1105	0.2532
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0012	0.1105	0.2376
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0012	0.1105	0.1105
Brugia malayi	Steroid receptor seven-up type 2	0.0012	0.1105	0.2532
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0006	0.017	0.0389
Brugia malayi	nuclear hormone receptor	0.0006	0.017	0.0389
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0012	0.1105	0.2532
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0006	0.017	0.0365
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0006	0.017	0.0365
Onchocerca volvulus		0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.2714	1
Echinococcus multilocularis	dna polymerase kappa	0.0023	0.2714	0.5837
Leishmania major	DNA polymerase kappa, putative	0.0007	0.0384	0.1415
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0023	0.2628	0.9683
Brugia malayi	steroid hormone receptor	0.0012	0.1105	0.2532
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.2714	0.622
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.2714	1
Trypanosoma brucei	DNA damage repair protein, putative	0.0007	0.0384	0.1415
Brugia malayi	Nuclear hormone receptor-like 1	0.0012	0.1105	0.2532
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0012	0.1105	0.2532
Plasmodium falciparum	DNA repair protein REV1, putative	0.0007	0.0384	0.1461
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.2714	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Leishmania major	DNA polymerase eta, putative	0.0023	0.2714	1
Trypanosoma cruzi	DNA damage repair protein, putative	0.0007	0.0384	0.1415
Brugia malayi	nuclear receptor NHR-67	0.0006	0.017	0.0389
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0009	0.0584	0.1257
Trypanosoma cruzi	DNA damage repair protein, putative	0.0007	0.0384	0.1415
Trypanosoma cruzi	DNA polymerase eta, putative	0.0023	0.2714	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0584	0.1257
Schistosoma mansoni	cpg binding protein	0.0037	0.465	0.465
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0012	0.1105	0.2376
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0023	0.2714	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0012	0.1105	0.1105
Trypanosoma brucei	chrX additional, unordered contigs	0.0007	0.0384	0.1415
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0006	0.017	0.0365
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0006	0.017	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Echinococcus multilocularis	FTZ F1 alpha	0.0012	0.1105	0.2376
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.2628	0.9683
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0023	0.2714	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0012	0.1105	0.2376
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0012	0.1105	0.2532
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0023	0.2714	1
Schistosoma mansoni	DNA polymerase eta	0.0023	0.2714	0.2714
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0012	0.1105	0.2532
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Echinococcus multilocularis	ecdysone induced protein 78C	0.0012	0.1105	0.2376
Brugia malayi	hypothetical protein	0.0006	0.027	0.0619
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.027	0.0619
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0012	0.1105	0.2376
Echinococcus granulosus	thyroid hormone receptor alpha	0.0006	0.017	0.0365
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Brugia malayi	polk-prov protein	0.0007	0.0384	0.088
Brugia malayi	Nuclear hormone receptor E75	0.0006	0.017	0.0389
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0006	0.017	0.0365
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.1105	0.2376
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.2714	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0012	0.1105	0.2532
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.2628	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0474	0.1748
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.2714	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0012	0.1105	0.2376
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0023	0.2714	0.622
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0006	0.027	0.027
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0023	0.2714	0.2714
Schistosoma mansoni	nuclear hormone receptor	0.0006	0.017	0.017
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1665	0.6136
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0012	0.1105	0.2532
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0012	0.1105	0.2532
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0023	0.2714	0.5837
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0474	0.1748
Loa Loa (eye worm)	hypothetical protein	0.0012	0.1105	0.2532
Loa Loa (eye worm)	hypothetical protein	0.0006	0.017	0.0389
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.1105	0.2532
Leishmania major	DNA damage repair protein, putative	0.0007	0.0384	0.1415

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.1169 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	0.2378 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 1 um	PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)]	ChEMBL.	No reference
Potency (functional)	= 5.6234 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	8.9125 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	17.7828 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	= 22.3872 um	PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of Mitochondrial Division or Activators of Mitochondrial Fusion. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	25.929 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	29.0929 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	30.1313 uM	PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411]	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (binding)	31.6228 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	32.6294 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PubChem BioAssay. qHTS of Nrf2 Activators. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (functional)	44.6684 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	56.2341 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23
Plasmodium falciparum	ChEMBL23

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: CHEMBL3194234

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1860029