TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 341.363 | Formula: C21H15N3O2
H donors: 0 H acceptors: 3 LogP: 2.87 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=C(c1ccncc1)Cc1nc2ccccc2c(=O)n1c1ccccc1
InChi: 1S/C21H15N3O2/c25-19(15-10-12-22-13-11-15)14-20-23-18-9-5-4-8-17(18)21(26)24(20)16-6-2-1-3-7-16/h1-13H,14H2
InChiKey: JWMIHRSYKDDUDK-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

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
Brugia malayi	ribonucleoside-diphosphate reductase large chain, putative	0.032	0.2326	0.4987
Echinococcus granulosus	glycine receptor subunit beta	0.0118	0.0729	0.2382
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0078	0.0416	0.1359
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0049	0.0105
Brugia malayi	Cyclin, N-terminal domain containing protein	0.009	0.0511	0.1097
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0054	0.0229	0.0491
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0081	0.0441	0.0441
Toxoplasma gondii	PAN domain-containing protein	0.0306	0.2216	0.9525
Onchocerca volvulus		0.0054	0.0229	0.0748
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Onchocerca volvulus	Putative nachr subunit	0.0414	0.3063	1
Toxoplasma gondii	aspartyl protease	0.0045	0.0156	0.057
Mycobacterium tuberculosis	Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog)	0.0095	0.0551	0.1958
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0215	0.0461
Onchocerca volvulus		0.0192	0.1316	0.4296
Echinococcus multilocularis	cyclin b3	0.0038	0.0097	0.0316
Loa Loa (eye worm)	aspartic protease BmAsp-2	0.0081	0.0441	0.0945
Trichomonas vaginalis	cyclin B, putative	0.009	0.0511	0.2101
Trichomonas vaginalis	cyclin B, putative	0.009	0.0511	0.2101
Plasmodium falciparum	plasmepsin X	0.0045	0.0156	0.0473
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0118	0.0729	0.1564
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0118	0.0729	0.1564
Schistosoma mansoni	cyclins	0.0038	0.0097	0.0097
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Echinococcus multilocularis	kelch ECH associated protein 1	0.0091	0.052	0.1697
Entamoeba histolytica	cyclin, putative	0.009	0.0511	0.1744
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Onchocerca volvulus		0.0054	0.0229	0.0748
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Leishmania major	cyclin	0.009	0.0511	0.2032
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0091	0.052	0.1697
Echinococcus granulosus	cyclins	0.0038	0.0097	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0063	0.0301	0.0301
Echinococcus granulosus	EGFP:Bcl2 fusion protein	0.0083	0.0454	0.1481
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0353	0.2579	1
Toxoplasma gondii	aspartyl protease ASP3	0.0045	0.0156	0.057
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0118	0.0729	0.0729
Schistosoma mansoni	neurotransmitter gated ion channel	0.0054	0.0229	0.0229
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0054	0.0229	0.0748
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0054	0.0229	0.0491
Echinococcus multilocularis	GPCR, family 2	0.0078	0.0416	0.1359
Onchocerca volvulus		0.0118	0.0729	0.2382
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Loa Loa (eye worm)	hypothetical protein	0.0095	0.0551	0.1181
Schistosoma mansoni	acetylcholine receptor-related	0.0054	0.0229	0.0229
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0118	0.0729	0.1564
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Schistosoma mansoni	hypothetical protein	0.0091	0.0522	0.0522
Entamoeba histolytica	DEAD/DEAH box helicase, putative	0.0095	0.0551	0.1901
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0095	0.0551	0.2301
Onchocerca volvulus		0.0118	0.0729	0.2382
Schistosoma mansoni	serine-type protease inhibitor	0.1294	1	1
Giardia lamblia	Translation initiation factor eIF-4A, putative	0.0095	0.0551	1
Schistosoma mansoni	nAChR subunit	0.0054	0.0229	0.0229
Onchocerca volvulus	Eukaryotic initiation factor 4A homolog	0.0095	0.0551	0.1798
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Echinococcus multilocularis	ribonucleoside diphosphate reductase large	0.032	0.2326	0.7593
Brugia malayi	hypothetical protein	0.0054	0.0229	0.0491
Schistosoma mansoni	hypothetical protein	0.0078	0.0416	0.0416
Echinococcus granulosus	Bcl 2 ous antagonist:killer	0.0083	0.0454	0.1481
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0192	0.1316	0.1316
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0192	0.1316	0.1316
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0617	0.4664	1
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Loa Loa (eye worm)	hypothetical protein	0.009	0.0511	0.1097
Brugia malayi	aspartic protease BmAsp-2, identical	0.0045	0.0156	0.0336
Brugia malayi	hypothetical protein	0.0054	0.0229	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0156	0.0336
Loa Loa (eye worm)	TK/ROR protein kinase	0.0033	0.0057	0.0122
Wolbachia endosymbiont of Brugia malayi	ribonucleotide-diphosphate reductase subunit alpha	0.0288	0.2069	0.5
Trichomonas vaginalis	cyclins, putative	0.009	0.0511	0.2101
Schistosoma mansoni	hypothetical protein	0.0083	0.0454	0.0454
Schistosoma mansoni	cyclin B3	0.0038	0.0097	0.0097
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0078	0.0416	0.0893
Toxoplasma gondii	aspartyl proteinase (eimepsin), putative	0.0081	0.0441	0.1805
Brugia malayi	latrophilin 2 splice variant baaae	0.0169	0.1131	0.2425
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0054	0.0229	0.0748
Schistosoma mansoni	hypothetical protein	0.0035	0.0075	0.0075
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0118	0.0729	0.0729
Schistosoma mansoni	hypothetical protein	0.0078	0.0416	0.0416
Toxoplasma gondii	eukaryotic aspartyl protease superfamily protein	0.0045	0.0156	0.057
Brugia malayi	Cation transporter family protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	hypothetical protein	0.0247	0.1747	0.3745
Brugia malayi	Eukaryotic aspartyl protease family protein	0.0045	0.0156	0.0336
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0118	0.0729	0.2382
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0118	0.0729	0.2382
Loa Loa (eye worm)	hypothetical protein	0.0169	0.1131	0.2425
Echinococcus multilocularis	nAChR subunit	0.0118	0.0729	0.2382
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0075	0.0243
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0454	0.0973
Schistosoma mansoni	hypothetical protein	0.0078	0.0416	0.0416
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0887	0.1902
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0075	0.0243
Trichomonas vaginalis	ribonucleoside-diphosphate reductase alpha chain, putative	0.0288	0.2069	1
Plasmodium vivax	plasmepsin IV, putative	0.0081	0.0441	0.172
Echinococcus granulosus	cyclins	0.0038	0.0097	0.0316
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0095	0.0551	0.2204
Mycobacterium tuberculosis	Ribonucleoside-diphosphate reductase (alpha chain) NrdE (ribonucleotide reductase small subunit) (R1F protein)	0.0288	0.2069	0.7979
Leishmania major	eukaryotic initiation factor 4a, putative	0.0095	0.0551	0.2204
Trichomonas vaginalis	cyclin A, putative	0.009	0.0511	0.2101
Schistosoma mansoni	memapsin-2 (A01 family)	0.0858	0.6561	0.6561
Brugia malayi	hypothetical protein	0.0054	0.0229	0.0491
Plasmodium falciparum	plasmepsin VII	0.0045	0.0156	0.0473
Brugia malayi	Latrophilin receptor protein 2	0.0078	0.0416	0.0893
Echinococcus granulosus	eukaryotic initiation factor 4A III	0.0095	0.0551	0.1798
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0054	0.0229	0.0491
Echinococcus multilocularis	tissue type plasminogen activator	0.0031	0.0049	0.0159
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0414	0.3063	1
Schistosoma mansoni	cathepsin D (A01 family)	0.0173	0.1165	0.1165
Plasmodium vivax	RNA helicase-1, putative	0.0095	0.0551	0.2204
Trichomonas vaginalis	cyclins, putative	0.009	0.0511	0.2101
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0617	0.4664	1
Plasmodium vivax	aspartyl protease, putative	0.0045	0.0156	0.0473
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0063	0.0301	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1316	0.2821
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0091	0.052	0.1697
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Entamoeba histolytica	cyclin, putative	0.0038	0.0097	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0118	0.0729	0.0729
Loa Loa (eye worm)	apoptosis regulator protein	0.0083	0.0454	0.0973
Loa Loa (eye worm)	ribonucleoside-diphosphate reductase large subunit	0.032	0.2326	0.4987
Mycobacterium ulcerans	hypothetical protein	0.0353	0.2579	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	ACC-1 protein	0.0118	0.0729	0.1564
Toxoplasma gondii	eukaryotic initiation factor-4A, putative	0.0095	0.0551	0.2284
Trypanosoma brucei	Eukaryotic initiation factor 4A-1	0.0095	0.0551	0.0217
Trypanosoma cruzi	ribonucleoside-diphosphate reductase large chain, putative	0.0088	0.0497	0.1967
Loa Loa (eye worm)	cyclin domain-containing protein	0.0038	0.0097	0.0208
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0063	0.0301	0.0645
Plasmodium falciparum	ribonucleoside-diphosphate reductase large subunit, putative	0.032	0.2326	1
Schistosoma mansoni	hypothetical protein	0.0031	0.0049	0.0049
Plasmodium falciparum	plasmepsin I	0.0081	0.0441	0.172
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0063	0.0301	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0063	0.0301	0.0301
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0078	0.0416	0.0893
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Plasmodium falciparum	plasmepsin IV	0.0081	0.0441	0.172
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0054	0.0229	0.0748
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0247	0.1747	0.3745
Echinococcus multilocularis	EGFP:Bcl2 fusion protein	0.0083	0.0454	0.1481
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0414	0.3063	0.6567
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Mycobacterium tuberculosis	Probable ribonucleoside-diphosphate reductase (large subunit) NrdZ (ribonucleotide reductase)	0.0103	0.0616	0.2218
Toxoplasma gondii	ribonucleoside-diphosphate reductase large chain	0.032	0.2326	1
Schistosoma mansoni	hypothetical protein	0.0169	0.1131	0.1131
Echinococcus multilocularis	Kelch repeat type 1	0.0091	0.0522	0.1704
Giardia lamblia	G2/mitotic-specific cyclin B	0.009	0.0511	0.9133
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0078	0.0416	0.1359
Echinococcus granulosus	tissue type plasminogen activator	0.0031	0.0049	0.0159
Brugia malayi	Pepsin A precursor	0.0045	0.0156	0.0336
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Brugia malayi	Cyclin, N-terminal domain containing protein	0.009	0.0511	0.1097
Loa Loa (eye worm)	aspartyl protease 6	0.0045	0.0156	0.0336
Entamoeba histolytica	hypothetical protein	0.0063	0.0301	0.0904
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0038	0.0097	0.0208
Brugia malayi	eukaryotic initiation factor 4A	0.0095	0.0551	0.1181
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0118	0.0729	0.1564
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0054	0.0229	0.0491
Trichomonas vaginalis	cyclin B, putative	0.009	0.0511	0.2101
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Trypanosoma cruzi	cyclin 6, putative	0.009	0.0511	0.2032
Plasmodium falciparum	eukaryotic initiation factor 4A	0.0095	0.0551	0.2204
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1316	0.2821
Echinococcus multilocularis	cyclin B	0.009	0.0511	0.167
Schistosoma mansoni	apoptosis regulator bax	0.0083	0.0454	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus multilocularis	eukaryotic initiation factor 4A	0.0095	0.0551	0.1798
Trypanosoma cruzi	cyclin, putative	0.009	0.0511	0.2032
Toxoplasma gondii	aspartyl protease ASP1	0.0081	0.0441	0.1805
Schistosoma mansoni	neurotransmitter gated ion channel	0.0054	0.0229	0.0229
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0054	0.0229	0.0491
Plasmodium falciparum	plasmepsin III	0.0045	0.0156	0.0473
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0414	0.3063	1
Plasmodium vivax	aspartyl protease, putative	0.0045	0.0156	0.0473
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0095	0.0551	0.2204
Echinococcus granulosus	cathepsin d lysosomal aspartyl protease	0.0081	0.0441	0.1438
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0034	0.0068	0.0068
Echinococcus granulosus	nAChR subunit	0.0063	0.0301	0.0983
Loa Loa (eye worm)	LGC-31 protein	0.0118	0.0729	0.1564
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.009	0.0511	0.2032
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0118	0.0729	0.0729
Loa Loa (eye worm)	GABA receptor subunit	0.0063	0.0301	0.0645
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0118	0.0729	0.1564
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Plasmodium vivax	aspartyl protease, putative	0.0045	0.0156	0.0473
Mycobacterium leprae	conserved hypothetical protein	0.0353	0.2579	1
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Plasmodium vivax	aspartyl proteinase, putative	0.0081	0.0441	0.172
Onchocerca volvulus		0.0063	0.0301	0.0983
Brugia malayi	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus granulosus	nAChR subunit	0.0118	0.0729	0.2382
Onchocerca volvulus		0.0054	0.0229	0.0748
Echinococcus granulosus	cyclin B3 1	0.0038	0.0097	0.0316
Plasmodium vivax	plasmepsin V, putative	0.0045	0.0156	0.0473
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0118	0.0729	0.1564
Trypanosoma cruzi	ribonucleoside-diphosphate reductase large chain, putative	0.032	0.2326	1
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0054	0.0229	0.0491
Toxoplasma gondii	PAN domain-containing protein	0.0306	0.2216	0.9525
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0414	0.3063	0.6567
Echinococcus multilocularis	cyclin B3 1	0.0038	0.0097	0.0316
Echinococcus multilocularis	kelch ECH associated protein 1	0.0091	0.052	0.1697
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Onchocerca volvulus		0.009	0.0511	0.167
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Entamoeba histolytica	cyclin family protein	0.0038	0.0097	0.0089
Echinococcus multilocularis	glycine receptor subunit beta	0.0118	0.0729	0.2382
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0118	0.0729	0.1564
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0118	0.0729	0.2382
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0414	0.3063	0.6567
Trichomonas vaginalis	cyclins, putative	0.009	0.0511	0.2101
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0414	0.3063	1
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0118	0.0729	0.1564
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0118	0.0729	0.2382
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0118	0.0729	0.1564
Echinococcus granulosus	kelch ECH associated protein 1	0.0091	0.052	0.1697
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0095	0.0551	0.2301
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0118	0.0729	0.1564
Schistosoma mansoni	neurotransmitter gated ion channel	0.0063	0.0301	0.0301
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Brugia malayi	hypothetical protein	0.0045	0.0156	0.0336
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0078	0.0416	0.1359
Plasmodium falciparum	plasmepsin VIII, putative	0.0045	0.0156	0.0473
Trypanosoma brucei	ribonucleoside-diphosphate reductase large chain	0.032	0.2326	1
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0054	0.0229	0.0748
Onchocerca volvulus		0.0192	0.1316	0.4296
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Echinococcus granulosus	GPCR family 2	0.0078	0.0416	0.1359
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0118	0.0729	0.2382
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0118	0.0729	0.2382
Schistosoma mansoni	cyclin B	0.009	0.0511	0.0511
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0054	0.0229	0.0748
Trypanosoma cruzi	CYC2-like cyclin, putative	0.009	0.0511	0.2032
Onchocerca volvulus		0.0063	0.0301	0.0983
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0414	0.3063	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Trichomonas vaginalis	cyclins, putative	0.0062	0.0287	0.0962
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0054	0.0229	0.0229
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0118	0.0729	0.1564
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0118	0.0729	0.2382
Toxoplasma gondii	kringle domain-containing protein	0.0031	0.0049	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Echinococcus granulosus	ribonucleoside diphosphate reductase large	0.032	0.2326	0.7593
Brugia malayi	Cation transporter family protein	0.0192	0.1316	0.2821
Brugia malayi	Apoptosis regulator proteins, Bcl-2 family protein	0.0083	0.0454	0.0973
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Mycobacterium tuberculosis	Conserved protein	0.0353	0.2579	1
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0095	0.0551	0.0551
Schistosoma mansoni	ribonucleoside-diphosphate reductase alpha subunit	0.032	0.2326	0.2326
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Chlamydia trachomatis	ribonucleoside-diphosphate reductase subunit alpha	0.032	0.2326	1
Brugia malayi	excitatory GABA receptor EXP-1A	0.0118	0.0729	0.1564
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0416	0.0893
Onchocerca volvulus		0.0045	0.0156	0.0511
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0038	0.0097	0.0316
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0095	0.0551	0.0551
Plasmodium falciparum	plasmepsin IX	0.0045	0.0156	0.0473
Echinococcus multilocularis	nAChR subunit	0.0063	0.0301	0.0983
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Brugia malayi	aspartic protease BmAsp-1, identical	0.0045	0.0156	0.0336
Echinococcus multilocularis	cathepsin d (lysosomal aspartyl protease)	0.0081	0.0441	0.1438
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0063	0.0301	0.0645
Echinococcus granulosus	eukaryotic initiation factor 4A	0.0095	0.0551	0.1798
Onchocerca volvulus		0.0045	0.0156	0.0511
Brugia malayi	Cation transporter family protein	0.0118	0.0729	0.1564
Plasmodium vivax	aspartyl proteinase, putative	0.0045	0.0156	0.0473
Plasmodium falciparum	plasmepsin VI	0.0081	0.0441	0.172
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0301	0.0645
Schistosoma mansoni	hypothetical protein	0.0078	0.0416	0.0416
Entamoeba histolytica	cyclin family protein	0.0038	0.0097	0.0089
Echinococcus granulosus	cyclins	0.0038	0.0097	0.0316
Treponema pallidum	ribonucleotide-diphosphate reductase subunit alpha	0.032	0.2326	1
Onchocerca volvulus		0.0118	0.0729	0.2382
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Plasmodium vivax	ribonucleoside-diphosphate reductase large chain, putative	0.032	0.2326	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Echinococcus granulosus	cyclin b3	0.0038	0.0097	0.0316
Entamoeba histolytica	hypothetical protein, conserved	0.0353	0.2579	1
Mycobacterium ulcerans	ribonucleotide-diphosphate reductase subunit alpha	0.0288	0.2069	0.7979
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0118	0.0729	0.2382
Echinococcus multilocularis	eukaryotic initiation factor 4A III	0.0095	0.0551	0.1798
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0118	0.0729	0.2382
Schistosoma mansoni	bcl-2 homologous antagonist/killer (bak)	0.0083	0.0454	0.0454
Echinococcus granulosus	cyclin B	0.009	0.0511	0.167
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Trichomonas vaginalis	cyclins, putative	0.009	0.0511	0.2101
Schistosoma mansoni	hypothetical protein	0.0083	0.0454	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0441	0.0945
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0095	0.0551	0.2301
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Onchocerca volvulus		0.0031	0.0049	0.0159
Plasmodium falciparum	plasmepsin II	0.0081	0.0441	0.172
Schistosoma mansoni	nAChR subunit	0.0054	0.0229	0.0229
Brugia malayi	hypothetical protein	0.0054	0.0229	0.0491
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0054	0.0229	0.0491
Leishmania major	eukaryotic initiation factor 4a, putative	0.0095	0.0551	0.2204
Brugia malayi	hypothetical protein	0.0035	0.0075	0.016
Trichomonas vaginalis	cyclin B, putative	0.009	0.0511	0.2101
Plasmodium falciparum	plasmepsin V	0.0045	0.0156	0.0473
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Brugia malayi	Protein kinase domain containing protein	0.0033	0.0057	0.0122
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0038	0.0097	0.0316
Trichomonas vaginalis	Clan AA, family A1, cathepsin D-like aspartic peptidase	0.0081	0.0441	0.1742
Loa Loa (eye worm)	acetylcholine receptor protein	0.0054	0.0229	0.0491
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Schistosoma mansoni	cathepsin D (A01 family)	0.0173	0.1165	0.1165
Echinococcus granulosus	cyclins	0.0038	0.0097	0.0316
Echinococcus multilocularis	Bcl 2 ous antagonist:killer	0.0083	0.0454	0.1481
Loa Loa (eye worm)	aspartic protease BmAsp-1	0.0045	0.0156	0.0336
Trypanosoma cruzi	cyclin, putative	0.009	0.0511	0.2032
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0414	0.3063	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Echinococcus multilocularis	glycine receptor subunit beta	0.0118	0.0729	0.2382
Leishmania major	ribonucleoside-diphosphate reductase large chain, putative	0.032	0.2326	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0078	0.0416	0.1359
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0118	0.0729	0.1564
Mycobacterium ulcerans	hypothetical protein	0.0353	0.2579	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.0491
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0156	0.0336
Brugia malayi	Kringle domain containing protein	0.0031	0.0049	0.0105
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0414	0.3063	1
Echinococcus multilocularis	cyclins	0.0038	0.0097	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0729	0.1564
Echinococcus granulosus	cyclins	0.0038	0.0097	0.0316
Brugia malayi	hypothetical protein	0.0045	0.0156	0.0336
Loa Loa (eye worm)	hypothetical protein	0.009	0.0511	0.1097
Plasmodium falciparum	cyclin	0.0038	0.0097	0.0211
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0118	0.0729	0.2382
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0054	0.0229	0.0491
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0045	0.0156	0.0156
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0729	0.1564
Onchocerca volvulus		0.0192	0.1316	0.4296
Loa Loa (eye worm)	ACC-1 protein	0.0118	0.0729	0.1564
Echinococcus granulosus	glycine receptor subunit beta	0.0118	0.0729	0.2382
Schistosoma mansoni	hypothetical protein	0.0083	0.0454	0.0454
Schistosoma mansoni	nAChR subunit	0.0118	0.0729	0.0729
Mycobacterium leprae	RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE (ALPHA CHAIN) NRDE (RIBONUCLEOTIDE REDUCTASE SMALL SUBUNIT) (R1F PROTEIN)	0.0288	0.2069	0.7979

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)		scMet test was conducted by administration of convulsant dose (CD97) of pentylenetetrazol (85 mg/kg in mice) at 4h. ( toxicity at 300 mg/kg); + denotes active at 300 mg/kg	ChEMBL.	2296016
Activity (functional)		Anticonvulsant activity was determined in maximal electroshock seizure test 4.0 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)		Anticonvulsant activity was determined in maximal electroshock seizure test 0.5 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (ADMET)		Rotorod test was used to evaluate neurotoxicity in mice. Toxicity values are reported after 4.0 h; - denotes no activity or toxicity observed at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)		Anticonvulsant activity was determined in Subcutaneous metrazole (scMet) test 0.5 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (ADMET)		Rotorod test was used to evaluate neurotoxicity in mice. Toxicity values are reported after 0.5 h; - denotes no activity or toxicity observed at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)	NT 0	Anticonvulsant activity was determined in maximal electroshock seizure test 0.5 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)	NT 0	Anticonvulsant activity was determined in maximal electroshock seizure test 4.0 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)	NT 0	Anticonvulsant activity was determined in Subcutaneous metrazole (scMet) test 0.5 h after administration of 300 mg/kg; - denotes no activity or toxicityobserved at 300 mg/kg.	ChEMBL.	2296016
Activity (functional)	0	scMet test was conducted by administration of convulsant dose (CD97) of pentylenetetrazol (85 mg/kg in mice) at 4h. ( toxicity at 300 mg/kg); + denotes active at 300 mg/kg	ChEMBL.	2296016
Activity (ADMET)	NT 0	Rotorod test was used to evaluate neurotoxicity in mice. Toxicity values are reported after 0.5 h; - denotes no activity or toxicity observed at 300 mg/kg.	ChEMBL.	2296016
Activity (ADMET)	NT 0	Rotorod test was used to evaluate neurotoxicity in mice. Toxicity values are reported after 4.0 h; - denotes no activity or toxicity observed at 300 mg/kg.	ChEMBL.	2296016

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.

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External resources for this compound

ChEMBL: CHEMBL43621

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 62341