TDR Targets

Basic information

Technical information

TDR Targets ID: 1436113
Name: 5-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)-1 ,2-oxazole-3-carboxamide
MW: 380.236 | Formula: C16H18BrN3O3
H donors: 1 H acceptors: 2 LogP: 2 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=C(c1noc(c1)c1ccc(cc1)Br)NCCN1CCOCC1
InChi: 1S/C16H18BrN3O3/c17-13-3-1-12(2-4-13)15-11-14(19-23-15)16(21)18-5-6-20-7-9-22-10-8-20/h1-4,11H,5-10H2,(H,18,21)
InChiKey: DFGZKYMXPGUWPF-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

5-(4-bromophenyl)-N-(2-morpholinoethyl)isoxazole-3-carboxamide
5-(4-bromophenyl)-N-(2-morpholinoethyl)-3-isoxazolecarboxamide
SMR000023249
5-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)isoxazole-3-carboxamide
MLS000087026

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	breast cancer 1, early onset	Starlite/ChEMBL	No references
Homo sapiens	mitogen-activated protein kinase 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	mitogen activated protein kinase 3	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	mitogen activated protein kinase 3	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei	protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Brugia malayi	MAP kinase sur-1	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	MAP kinase-like orf	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania donovani	mitogen activated protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	MAP kinase implicated in PKC1-controlled signalling pathway	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei gambiense	mitogen-activated protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania mexicana	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	Serine/threonine protein kinase of MAP kinase family	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	Serine/threonine protein kinase of MAP kinase family	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei gambiense	protein kinase, putative,tyrosine protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	ko:K04371 extracellular signal-regulated kinase 1/2, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Cryptosporidium hominis	MAPK	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	Mitogen-activated protein kinase 3, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma brucei	mitogen activated protein kinase 4, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Candida albicans	MAP kinase-like orf	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Giardia lamblia	Kinase, CMGC MAPK	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania braziliensis	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440,map kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania infantum	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania donovani	mitogen-activated protein kinase 4	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus granulosus	mitogen activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania infantum	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma japonicum	Mitogen-activated protein kinase 3, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania braziliensis	mitogen activated protein kinase, putative,map kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania mexicana	mitogen-activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Echinococcus multilocularis	mitogen activated protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Cryptosporidium parvum	MAPK, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma congolense	tyrosine protein kinase, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	Get druggable targets OG5_126781	All targets in OG5_126781
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	Get druggable targets OG5_126781	All targets in OG5_126781
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_126781	All targets in OG5_126781

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	mitogen-activated protein kinase 1	360 aa	361 aa	33.2 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	hypothetical protein	0.0216	0.6433	0.6837
Plasmodium vivax	hypothetical protein, conserved	0.0038	0.0888	0.4763
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Schistosoma mansoni	hypothetical protein	0.0177	0.5212	0.5536
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0049	0.0052
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Onchocerca volvulus	Dual oxidase homolog	0.0242	0.7241	0.7696
Mycobacterium ulcerans	lipase LipD	0.0038	0.0888	1
Brugia malayi	beta-lactamase	0.0038	0.0888	0.0944
Toxoplasma gondii	NADPH-glutathione reductase	0.0023	0.043	0.2404
Mycobacterium tuberculosis	Probable lipase LipD	0.0038	0.0888	0.1238
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0066	0.1765	0.1869
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0017	0.0239	0.0247
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0888	0.4505
Schistosoma mansoni	chromosome transmission fidelity factor	0.0012	0.0091	0.009
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0069	0.1861	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.0049	0.0052
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0023	0.043	1
Brugia malayi	Bloom's syndrome protein homolog	0.0022	0.0413	0.0439
Schistosoma mansoni	topbp1	0.0012	0.0091	0.009
Mycobacterium ulcerans	esterase/lipase LipP	0.0038	0.0888	1
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0023	0.043	0.1913
Echinococcus multilocularis	replication factor c subunit 1	0.0012	0.0091	0.009
Brugia malayi	Thioredoxin reductase	0.0066	0.1765	0.1875
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Mycobacterium ulcerans	hypothetical protein	0.0038	0.0888	1
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0069	0.1861	0.1971
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.0049	0.0045
Echinococcus multilocularis	peroxidasin	0.0242	0.7241	0.7694
Brugia malayi	ATP dependent DNA ligase C terminal region family protein	0.0012	0.0091	0.0097
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0069	0.1861	0.1861
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0091	0.0559
Brugia malayi	Pax transcription activation domain interacting protein	0.0012	0.0091	0.0097
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0023	0.043	0.0599
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0023	0.043	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0069	0.1861	0.1899
Mycobacterium tuberculosis	Probable oxidoreductase	0.0023	0.043	0.0599
Brugia malayi	Blistered cuticle protein 3	0.0242	0.7241	0.7696
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.1634	1
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0062	0.1634	0.8722
Onchocerca volvulus		0.0011	0.0049	0.0052
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.0049	0.0045
Brugia malayi	Animal haem peroxidase family protein	0.0242	0.7241	0.7696
Echinococcus granulosus	mitogen activated protein kinase 3	0.0062	0.1634	0.1731
Trypanosoma cruzi	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.0012	0.0091	0.0001
Schistosoma mansoni	thyroid hormone receptor	0.0142	0.4128	0.4383
Giardia lamblia	Sgs1 DNA helicase, putative	0.0009	0.0007	0.0045
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.0049	0.0052
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Schistosoma mansoni	peroxidasin	0.0242	0.7241	0.7694
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.0049	0.0045
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.0049	0.0045
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.0049	0.0045
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0023	0.043	0.4245
Leishmania major	hypothetical protein, conserved	0.0038	0.0888	0.4505
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.0049	0.0052
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0007	0.0008
Entamoeba histolytica	hypothetical protein, conserved	0.0312	0.9409	1
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0017	0.0242	0.0257
Brugia malayi	nuclear receptor NHR-88	0.0011	0.0049	0.0052
Schistosoma mansoni	hypothetical protein	0.0017	0.0239	0.0247
Echinococcus granulosus	protein cereblon	0.0312	0.9409	1
Schistosoma mansoni	coup transcription factor	0.0011	0.0049	0.0045
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0888	0.0937
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0038	0.0888	0.1238
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.0049	0.0049
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Brugia malayi	hypothetical protein	0.0012	0.0091	0.0097
Schistosoma mansoni	thyroid hormone receptor	0.0142	0.4128	0.4383
Echinococcus multilocularis	transcription factor Dp 1	0.004	0.096	0.1013
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.0049	0.0049
Loa Loa (eye worm)	animal heme peroxidase	0.0242	0.7241	0.7241
Schistosoma mansoni	hypothetical protein	0.0131	0.3801	0.4035
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.1634	1
Schistosoma mansoni	hypothetical protein	0.0177	0.5212	0.5536
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0038	0.0888	0.0888
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0049	0.0052
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0009	0.0007	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0839	0.0839
Brugia malayi	Animal haem peroxidase family protein	0.0242	0.7241	0.7696
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0023	0.043	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0036	0.0839	0.0892
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.0049	0.0045
Toxoplasma gondii	ABC1 family protein	0.0038	0.0888	0.5014
Onchocerca volvulus		0.0038	0.0888	0.0944
Mycobacterium leprae	Probable lipase LipE	0.0038	0.0888	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0049	0.0052
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Schistosoma mansoni	serine/threonine protein kinase	0.0062	0.1634	0.1731
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.0049	0.0049
Echinococcus multilocularis	protein cereblon	0.0312	0.9409	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0049	0.0052
Toxoplasma gondii	thioredoxin reductase	0.0066	0.1765	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0049	0.0045
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0023	0.043	0.4837
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0091	0.0559
Onchocerca volvulus		0.0038	0.0888	0.0944
Trypanosoma brucei	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.0012	0.0091	0.0001
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0023	0.043	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0017	0.0239	0.0247
Brugia malayi	beta-lactamase family protein	0.0038	0.0888	0.0944
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0038	0.0888	0.0944
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0038	0.0888	1
Onchocerca volvulus	Peroxidasin homolog	0.0242	0.7241	0.7696
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.0049	0.0052
Plasmodium falciparum	replication factor C subunit 1, putative	0.0012	0.0091	0.0479
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.0049	0.0049
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0023	0.043	0.1913
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.0049	0.0045
Brugia malayi	Latrophilin receptor protein 2	0.0017	0.0239	0.0254
Schistosoma mansoni	hypothetical protein	0.0017	0.0239	0.0247
Mycobacterium leprae	conserved hypothetical protein	0.0038	0.0888	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Trichomonas vaginalis	glutathione reductase, putative	0.0023	0.043	0.2629
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.0049	0.0045
Leishmania major	trypanothione reductase	0.0066	0.1765	0.9457
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0023	0.043	0.4837
Brugia malayi	hypothetical protein	0.0012	0.0091	0.0097
Brugia malayi	steroid hormone receptor	0.0011	0.0049	0.0052
Brugia malayi	DKFZp564C0469 protein	0.0012	0.0091	0.0097
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0023	0.043	0.1913
Mycobacterium tuberculosis	Probable esterase LipL	0.0038	0.0888	0.1238
Giardia lamblia	Replication factor C, subunit 1	0.0012	0.0091	0.0559
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0049	0.0052
Trypanosoma brucei	protein kinase, putative	0.0062	0.1634	0.8722
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0023	0.043	0.1913
Trichomonas vaginalis	DNA helicase recq, putative	0.0012	0.0091	0.0558
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0053	0.1357	0.1442
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0049	0.0045
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0888	0.5435
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0069	0.1861	1
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0062	0.1634	0.8722
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0888	0.1238
Schistosoma mansoni	hypothetical protein	0.0017	0.0239	0.0247
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0049	0.0045
Echinococcus granulosus	beta LACTamase domain containing family member	0.0038	0.0888	0.0937
Brugia malayi	Animal haem peroxidase family protein	0.0242	0.7241	0.7696
Plasmodium vivax	glutathione reductase, putative	0.0066	0.1765	1
Trichomonas vaginalis	replication factor C large subunit, putative	0.0012	0.0091	0.0559
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0888	0.5435
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0091	0.0559
Loa Loa (eye worm)	animal heme peroxidase	0.0242	0.7241	0.7241
Echinococcus granulosus	peroxidasin	0.0242	0.7241	0.7694
Brugia malayi	sulfakinin receptor protein	0.0216	0.6433	0.6837
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0066	0.1765	0.2459
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.0049	0.0045
Loa Loa (eye worm)	thioredoxin reductase	0.0066	0.1765	0.1765
Brugia malayi	topoisomerase	0.0012	0.0091	0.0097
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.0049	0.0052
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0888	0.1238
Loa Loa (eye worm)	hypothetical protein	0.0216	0.6433	0.6433
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.0049	0.0045
Plasmodium falciparum	glutathione reductase	0.0066	0.1765	1
Onchocerca volvulus		0.0038	0.0888	0.0944
Trypanosoma cruzi	hypothetical protein, conserved	0.0012	0.0091	0.0001
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0023	0.043	0.0599
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Plasmodium vivax	thioredoxin reductase, putative	0.0066	0.1765	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.0049	0.0045
Plasmodium falciparum	thioredoxin reductase	0.0066	0.1765	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.0049	0.0045
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.0049	0.0045
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0017	0.0239	0.0247
Trypanosoma brucei	hypothetical protein, conserved	0.0038	0.0888	0.4505
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.0049	0.0049
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0023	0.043	0.4837
Trypanosoma cruzi	trypanothione reductase, putative	0.0066	0.1765	0.9457
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0062	0.1634	0.8722
Brugia malayi	glutathione reductase	0.0066	0.1765	0.1875
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0245	0.735	0.735
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.1634	1
Treponema pallidum	NADH oxidase	0.0023	0.043	1
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0023	0.043	0.1913
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Onchocerca volvulus		0.0242	0.7241	0.7696
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.1634	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0888	0.5435
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0017	0.0239	0.0239
Brugia malayi	ecdysteroid receptor	0.0011	0.0049	0.0052
Echinococcus granulosus	bloom syndrome protein	0.0022	0.0413	0.0432
Onchocerca volvulus		0.0242	0.7241	0.7696
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0049	0.0052
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.0049	0.0045
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0038	0.0888	0.1238
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0023	0.043	0.0599
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.0023	0.043	0.2022
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0017	0.0239	0.0247
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1357	0.1357
Plasmodium falciparum	thioredoxin reductase	0.0023	0.043	0.2404
Plasmodium falciparum	glutathione reductase	0.0023	0.043	0.2404
Schistosoma mansoni	hypothetical protein	0.0036	0.0839	0.0885
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0131	0.3801	0.4035
Trichomonas vaginalis	mercuric reductase, putative	0.0023	0.043	0.2629
Brugia malayi	Animal haem peroxidase family protein	0.0242	0.7241	0.7696
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0023	0.043	0.1913
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Schistosoma mansoni	topbp1	0.0012	0.0091	0.009
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.0023	0.043	0.2022
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.0049	0.0052
Echinococcus multilocularis	GPCR, family 2	0.0017	0.0239	0.0247
Onchocerca volvulus		0.0012	0.0091	0.0097
Loa Loa (eye worm)	beta-lactamase	0.0038	0.0888	0.0888
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.0049	0.0045
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0062	0.1634	0.8722
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0069	0.1861	0.1971
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Onchocerca volvulus	Peroxidase homolog	0.0242	0.7241	0.7696
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0069	0.1861	0.1977
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0062	0.1634	0.1731
Brugia malayi	nuclear hormone receptor	0.0011	0.0049	0.0052
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.0023	0.043	0.2404
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0091	0.0559
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.0049	0.0052
Plasmodium vivax	ADP-dependent DNA helicase RecQ, putative	0.0015	0.0189	0.0585
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.0049	0.0049
Trichomonas vaginalis	DNA helicase recq1, putative	0.0022	0.0413	0.2528
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0888	0.1238
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.0049	0.0045
Brugia malayi	Animal haem peroxidase family protein	0.0242	0.7241	0.7696
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.0049	0.0049
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0012	0.0091	0.0559
Schistosoma mansoni	DNA ligase IV	0.0012	0.0091	0.009
Brugia malayi	follicle stimulating hormone receptor	0.0245	0.735	0.7812
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Trypanosoma brucei	trypanothione reductase	0.0066	0.1765	0.9457
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.0049	0.0045
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.002	0.0329	0.1832
Loa Loa (eye worm)	RecQ helicase	0.0022	0.0413	0.0413
Brugia malayi	Peroxidasin	0.0242	0.7241	0.7696
Loa Loa (eye worm)	glutathione reductase	0.0066	0.1765	0.1765
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0888	0.5435
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Trypanosoma cruzi	trypanothione reductase, putative	0.0023	0.043	0.1913
Mycobacterium tuberculosis	Probable lipase LipE	0.0038	0.0888	0.1238
Onchocerca volvulus	Chorion peroxidase homolog	0.0242	0.7241	0.7696
Schistosoma mansoni	hypothetical protein	0.0312	0.9409	1
Trichomonas vaginalis	DNA helicase recq, putative	0.0022	0.0413	0.2528
Brugia malayi	beta-lactamase family protein	0.0038	0.0888	0.0944
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.0049	0.0052
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.0023	0.043	0.2404
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0888	0.4505
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0015	0.0184	0.1005
Mycobacterium ulcerans	NAD-dependent DNA ligase LigA	0.0012	0.0091	0.1029
Echinococcus granulosus	GPCR family 2	0.0017	0.0239	0.0247
Mycobacterium ulcerans	beta-lactamase	0.0038	0.0888	1
Echinococcus multilocularis	mitogen activated protein kinase	0.0062	0.1634	0.1731
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0091	0.0091
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0038	0.0888	0.1238
Echinococcus multilocularis	nibrin	0.0012	0.0091	0.009
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0053	0.1357	0.1442
Echinococcus granulosus	nibrin	0.0012	0.0091	0.009
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0069	0.1861	1
Echinococcus multilocularis	bloom syndrome protein	0.0022	0.0413	0.0432
Loa Loa (eye worm)	animal heme peroxidase	0.0242	0.7241	0.7241
Onchocerca volvulus	Peroxidasin homolog	0.0242	0.7241	0.7696
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.0049	0.0052
Onchocerca volvulus		0.0242	0.7241	0.7696
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Echinococcus granulosus	thioredoxin glutathione reductase	0.0066	0.1765	0.1869
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0888	0.0888
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0062	0.1634	0.8722
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0053	0.1357	0.1357
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0888	0.5435
Brugia malayi	hypothetical protein	0.0127	0.3666	0.3896
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0062	0.1634	0.926
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0023	0.043	0.2404
Schistosoma mansoni	blooms syndrome DNA helicase	0.0018	0.0268	0.0277
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0007	0.0007
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0049	0.0052
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0023	0.043	0.1913
Schistosoma mansoni	hypothetical protein	0.0017	0.0239	0.0247
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0062	0.1634	0.1634
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.0049	0.0045
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0062	0.1634	0.8722
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0007	0.00000000073963
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.0012	0.0091	0.0479
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0023	0.043	0.0457
Loa Loa (eye worm)	hypothetical protein	0.0312	0.9409	0.9409
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.0049	0.0052
Loa Loa (eye worm)	animal heme peroxidase	0.0242	0.7241	0.7241
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0142	0.4128	0.4383
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.0012	0.0091	0.0559
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0012	0.0091	0.0559
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.0012	0.0091	0.0559
Onchocerca volvulus	Peroxidase homolog	0.0242	0.7241	0.7696
Toxoplasma gondii	ATPase, AAA family protein	0.0012	0.0091	0.0479
Schistosoma mansoni	peroxidasin	0.0242	0.7241	0.7694
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0017	0.0239	0.0254
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.0049	0.0045
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0049	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Mycobacterium tuberculosis	Probable hydrolase	0.0038	0.0888	0.1238
Trypanosoma cruzi	FHA domain containing protein, putative	0.0012	0.0091	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0242	0.7241	0.7241
Giardia lamblia	Kinase, CMGC MAPK	0.0062	0.1634	1
Echinococcus granulosus	transcription factor Dp 1	0.004	0.096	0.1013
Brugia malayi	hypothetical protein	0.0242	0.7241	0.7696
Echinococcus granulosus	mitogen activated protein kinase	0.0062	0.1634	0.1731
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0091	0.0559
Echinococcus multilocularis	geminin	0.0177	0.5212	0.5536
Echinococcus granulosus	geminin	0.0177	0.5212	0.5536
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0023	0.043	0.1913
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.0049	0.0045
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0038	0.0888	0.0937
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.0049	0.0052
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0131	0.3801	0.4035
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.0049	0.0045
Trichomonas vaginalis	esterase, putative	0.0038	0.0888	0.5435
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0888	0.0937
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0062	0.1634	0.8722
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0069	0.1861	1
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0023	0.043	0.0449
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0023	0.043	0.1913
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.024	0.7174	1
Brugia malayi	hypothetical protein	0.0312	0.9409	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0012	0.0091	0.0001
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0049	0.0045
Echinococcus granulosus	replication factor c subunit 1	0.0012	0.0091	0.009
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0069	0.1861	0.1971
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.0049	0.0052
Giardia lamblia	NADH oxidase lateral transfer candidate	0.0023	0.043	0.2629
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0273	0.0273
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0007	0.0008
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.0049	0.0045
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0023	0.043	0.0449
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0017	0.0242	0.0257
Loa Loa (eye worm)	blistered cuticle protein 3	0.0242	0.7241	0.7241
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0049	0.0049
Onchocerca volvulus	Protein cereblon homolog	0.0312	0.9409	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.0049	0.0049
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0239	0.0239
Brugia malayi	MAP kinase sur-1	0.0062	0.1634	0.1737

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.1 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	1.6511 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	5.6234 uM	PubChem BioAssay. qHTS Assay to Identify Small Molecule Activators of BRCA1 Expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.5893 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)	28.1838 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)	39.8107 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	112.2018 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
Homo sapiens	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: CHEMBL1604555

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1436113