TDR Targets

Basic information

Technical information

TDR Targets ID: 1296337
Name: N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-(1,3-b enzoxazol-2-ylsulfanyl)acetamide
MW: 333.323 | Formula: C13H11N5O4S
H donors: 2 H acceptors: 5 LogP: 1.18 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)Nc1nonc1NC(=O)CSc1nc2c(o1)cccc2
InChi: 1S/C13H11N5O4S/c1-7(19)14-11-12(18-22-17-11)16-10(20)6-23-13-15-8-4-2-3-5-9(8)21-13/h2-5H,6H2,1H3,(H,14,17,19)(H,16,18,20)
InChiKey: GKWRLSCSDDSZCN-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

N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-(1,3-benzoxazol-2-ylthio)acetamide
N-(4-acetamidofurazan-3-yl)-2-(1,3-benzoxazol-2-ylthio)acetamide
N-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-(1,3-benzoxazol-2-ylsulfanyl)ethanamide
MLS000045651
N-[4-(acetylamino)-1,2,5-oxadiazol-3-yl]-2-(1,3-benzoxazol-2-ylthio)acetamide
SMR000027608
ZINC00104859
Oprea1_021729
Acetamide, N-(4-acetylaminofurazan-3-yl)-2-(benzooxazol-2-ylsulfanyl)-
A2993/0126141

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Homo sapiens	adrenoceptor beta 2, surface	Starlite/ChEMBL	No references
Homo sapiens	K(lysine) acetyltransferase 2A	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium berghei	histone acetyltransferase GCN5, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Echinococcus granulosus	histone acetyltransferase KAT2B	Get druggable targets OG5_127781	All targets in OG5_127781
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	Get druggable targets OG5_127781	All targets in OG5_127781
Echinococcus granulosus	histone acetyltransferase KAT2B	Get druggable targets OG5_127781	All targets in OG5_127781
Neospora caninum	Bromodomain containing protein, related	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium knowlesi	histone acetyltransferase GCN5, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	Get druggable targets OG5_127781	All targets in OG5_127781
Schistosoma japonicum	ko:K06062 p300/CBP-associated factor, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Entamoeba histolytica	acetyltransferase, GNAT family	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium falciparum	histone acetyltransferase GCN5	Get druggable targets OG5_127781	All targets in OG5_127781
Neospora caninum	hypothetical protein	Get druggable targets OG5_127781	All targets in OG5_127781
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium vivax	histone acetyltransferase GCN5, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Cryptosporidium hominis	histone acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Theileria parva	histone acetyltransferase Gcn5, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Babesia bovis	histone acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Trichomonas vaginalis	bromodomain-containing protein, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Candida albicans	bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	Get druggable targets OG5_127781	All targets in OG5_127781
Loa Loa (eye worm)	acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Cryptosporidium parvum	GCN5 like acetylase + bromodomain	Get druggable targets OG5_127781	All targets in OG5_127781
Brugia malayi	acetyltransferase, GNAT family protein	Get druggable targets OG5_127781	All targets in OG5_127781
Giardia lamblia	Histone acetyltransferase GCN5	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium yoelii	histone acetyltransferase GCN5-related	Get druggable targets OG5_127781	All targets in OG5_127781

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	geminin	0.072	0.8326	1
Loa Loa (eye worm)	hypothetical protein	0.0366	0.4084	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0188	0.1954	0.2347
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0075	0.0605	0.0727
Schistosoma mansoni	hypothetical protein	0.0116	0.1092	0.1312
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0032	0.0095	0.0232
Onchocerca volvulus		0.0073	0.0577	0.2963
Loa Loa (eye worm)	hypothetical protein	0.0168	0.1724	0.4222
Brugia malayi	Steroid receptor seven-up type 2	0.0032	0.0095	0.0232
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0072	0.0572	0.0687
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0073	0.0577	0.0577
Brugia malayi	beta-lactamase	0.0073	0.0577	0.1414
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0043	0.0219	0.0219
Mycobacterium ulcerans	esterase/lipase LipP	0.0073	0.0577	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0073	0.0577	1
Schistosoma mansoni	hypothetical protein	0.0025	0.0001	0.0001
Echinococcus granulosus	beta LACTamase domain containing family member	0.0073	0.0577	0.0694
Mycobacterium tuberculosis	Probable lipase LipE	0.0073	0.0577	0.1097
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0032	0.0095	0.0114
Echinococcus multilocularis	zinc finger protein	0.0028	0.0037	0.0037
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0116	0.1092	0.1092
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0034	0.0112	0.0212
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0032	0.0095	0.0232
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0577	0.0694
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0032	0.0095	0.0232
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0032	0.0095	0.0232
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0032	0.0095	0.0114
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0032	0.0095	0.0095
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0254	0.0621
Loa Loa (eye worm)	steroid hormone receptor	0.0032	0.0095	0.0232
Echinococcus multilocularis	ecdysone induced protein 78C	0.0032	0.0095	0.0095
Echinococcus granulosus	fetal alzheimer antigen falz	0.0027	0.0028	0.0034
Toxoplasma gondii	aldehyde dehydrogenase	0.0072	0.0572	0.8742
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0075	0.0608	0.0608
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0073	0.0577	0.1097
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0054	0.0357	0.0429
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0178	0.1837	0.2206
Mycobacterium ulcerans	hypothetical protein	0.0073	0.0577	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0032	0.0095	0.0114
Schistosoma mansoni	transcription factor LCR-F1	0.0075	0.0605	0.0727
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0188	0.1954	0.2347
Mycobacterium tuberculosis	Probable hydrolase	0.0073	0.0577	0.1097
Schistosoma mansoni	microtubule-associated protein tau	0.0694	0.8022	0.9635
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0032	0.0095	0.0114
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0032	0.0095	0.0095
Echinococcus granulosus	FTZ F1 alpha	0.0415	0.4679	0.562
Schistosoma mansoni	zinc finger protein	0.0028	0.0037	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0032	0.0095	0.0232
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0035	0.0125	0.015
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0032	0.0095	0.0114
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0073	0.0577	0.1097
Brugia malayi	hypothetical protein	0.005	0.0308	0.0754
Schistosoma mansoni	RAR-like nuclear receptor	0.0032	0.0095	0.0114
Schistosoma mansoni	hypothetical protein	0.0116	0.1092	0.1312
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0075	0.0608	0.0731
Giardia lamblia	Histone acetyltransferase GCN5	0.0047	0.0272	0.5
Brugia malayi	nuclear receptor NHR-88	0.0032	0.0095	0.0232
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0032	0.0095	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0714	0.1748
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0054	0.0357	0.467
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0054	0.0357	0.467
Echinococcus granulosus	histone acetyltransferase KAT2B	0.017	0.1744	0.2095
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0188	0.1954	0.2347
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0072	0.0572	0.1086
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0577	0.1097
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0032	0.0095	0.0232
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0116	0.1092	0.1312
Brugia malayi	Bromodomain containing protein	0.0093	0.0826	0.2023
Brugia malayi	steroid hormone receptor	0.0032	0.0095	0.0232
Trypanosoma brucei	hypothetical protein, conserved	0.0073	0.0577	0.8854
Onchocerca volvulus		0.0073	0.0577	0.2963
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0072	0.0572	0.0572
Leishmania major	hypothetical protein, conserved	0.0078	0.0638	1
Plasmodium vivax	hypothetical protein, conserved	0.0073	0.0577	0.8854
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0032	0.0095	0.0232
Entamoeba histolytica	hypothetical protein	0.0075	0.0605	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0577	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0577	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0114	0.1068	0.2615
Brugia malayi	MH2 domain containing protein	0.0255	0.2763	0.6765
Plasmodium falciparum	ataxin-2 like protein, putative	0.0078	0.0638	1
Schistosoma mansoni	thyroid hormone receptor	0.0032	0.0095	0.0114
Schistosoma mansoni	thyroid hormone receptor	0.0032	0.0095	0.0114
Entamoeba histolytica	hypothetical protein	0.0075	0.0605	1
Leishmania major	hypothetical protein, conserved	0.0073	0.0577	0.8854
Loa Loa (eye worm)	beta-lactamase	0.0073	0.0577	0.1414
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0114	0.1068	0.2615
Schistosoma mansoni	hypothetical protein	0.0075	0.0605	0.0727
Brugia malayi	nuclear hormone receptor	0.0032	0.0095	0.0232
Loa Loa (eye worm)	acetyltransferase	0.0178	0.1837	0.4497
Echinococcus multilocularis	GPCR, family 2	0.0116	0.1092	0.1092
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0072	0.0572	0.9899
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0034	0.0112	0.0134
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0032	0.0095	0.0232
Toxoplasma gondii	LsmAD domain-containing protein	0.0078	0.0638	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0577	0.8854
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0043	0.0219	0.0263
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0027	0.0028	0.0034
Brugia malayi	beta-lactamase family protein	0.0073	0.0577	0.1414
Brugia malayi	hypothetical protein	0.0168	0.1724	0.4222
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0032	0.0095	0.0232
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0032	0.0095	0.0232
Plasmodium falciparum	histone acetyltransferase GCN5	0.0047	0.0272	0.3053
Brugia malayi	Bromodomain containing protein	0.005	0.0304	0.0744
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0178	0.1837	0.1837
Schistosoma mansoni	hypothetical protein	0.0081	0.0681	0.0818
Echinococcus multilocularis	microtubule associated protein 2	0.0694	0.8022	0.8022
Mycobacterium leprae	conserved hypothetical protein	0.0073	0.0577	1
Mycobacterium tuberculosis	Probable lipase LipD	0.0073	0.0577	0.1097
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0032	0.0095	0.0114
Echinococcus granulosus	GPCR family 2	0.0116	0.1092	0.1312
Brugia malayi	beta-lactamase family protein	0.0073	0.0577	0.1414
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0032	0.0095	0.0232
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0034	0.0112	0.0274
Schistosoma mansoni	hypothetical protein	0.025	0.2699	0.3242
Loa Loa (eye worm)	hypothetical protein	0.0116	0.1092	0.2674
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0032	0.0095	0.0095
Trichomonas vaginalis	esterase, putative	0.0073	0.0577	1
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0114	0.1068	0.1068
Brugia malayi	photoreceptor-specific nuclear receptor	0.0032	0.0095	0.0232
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0032	0.0095	0.0232
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0188	0.1954	0.2347
Brugia malayi	hypothetical protein	0.0078	0.0638	0.1561
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0116	0.1092	0.1092
Schistosoma mansoni	hypothetical protein	0.072	0.8326	1
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Brugia malayi	hypothetical protein	0.0075	0.0605	0.1482
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0032	0.0095	0.0232
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0577	0.1097
Schistosoma mansoni	hypothetical protein	0.0035	0.0125	0.015
Brugia malayi	acetyltransferase, GNAT family protein	0.0178	0.1837	0.4497
Loa Loa (eye worm)	hypothetical protein	0.025	0.2699	0.6609
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0032	0.0095	0.0095
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0032	0.0095	0.0114
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0032	0.0095	0.0232
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0034	0.0112	0.0112
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0366	0.4084	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0114	0.1068	0.1283
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Schistosoma mansoni	bromodomain containing protein	0.008	0.0659	0.0792
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0116	0.1092	0.2674
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0032	0.0095	0.0095
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0032	0.0095	0.0114
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0034	0.0112	0.0134
Schistosoma mansoni	aldehyde dehydrogenase	0.0072	0.0572	0.0687
Plasmodium vivax	ataxin-2 like protein, putative	0.0078	0.0638	1
Schistosoma mansoni	coup transcription factor	0.0032	0.0095	0.0114
Echinococcus granulosus	ecdysone induced protein 78C	0.0032	0.0095	0.0114
Mycobacterium ulcerans	lipase LipD	0.0073	0.0577	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0032	0.0095	0.0232
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0638	0.1561
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0577	0.8854
Brugia malayi	latrophilin 2 splice variant baaae	0.025	0.2699	0.6609
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0366	0.4084	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0188	0.1954	0.1954
Brugia malayi	PHD-finger family protein	0.0034	0.0113	0.0277
Schistosoma mansoni	hypothetical protein	0.072	0.8326	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0032	0.0095	0.0114
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0188	0.1954	0.4784
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0073	0.0577	0.1414
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0027	0.0028	0.0028
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0073	0.0577	0.1097
Trypanosoma brucei	PAB1-binding protein , putative	0.0078	0.0638	1
Schistosoma mansoni	hypothetical protein	0.0116	0.1092	0.1312
Schistosoma mansoni	hypothetical protein	0.0116	0.1092	0.1312
Onchocerca volvulus		0.0073	0.0577	0.2963
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0116	0.1092	0.1312
Loa Loa (eye worm)	MH2 domain-containing protein	0.0255	0.2763	0.6765
Brugia malayi	Latrophilin receptor protein 2	0.0116	0.1092	0.2674
Brugia malayi	isocitrate dehydrogenase	0.0034	0.0112	0.0274
Toxoplasma gondii	ABC1 family protein	0.0073	0.0577	0.8854
Mycobacterium leprae	Probable lipase LipE	0.0073	0.0577	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0577	1
Mycobacterium ulcerans	beta-lactamase	0.0073	0.0577	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0188	0.1954	0.1954
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0072	0.0572	0.9899
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0072	0.0572	0.8742
Mycobacterium tuberculosis	Probable esterase LipL	0.0073	0.0577	0.1097
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0188	0.1954	0.4784
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0073	0.0577	0.1414
Entamoeba histolytica	hypothetical protein	0.0075	0.0605	1
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0577	0.1414
Schistosoma mansoni	nuclear hormone receptor	0.0032	0.0095	0.0114
Trypanosoma cruzi	PAB1-binding protein , putative	0.0078	0.0638	1
Entamoeba histolytica	hypothetical protein	0.0075	0.0605	1
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0035	0.0125	0.0125
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0464	0.5266	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0032	0.0095	0.0114
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0034	0.0112	0.0112
Loa Loa (eye worm)	transcription factor SMAD2	0.0255	0.2763	0.6765
Loa Loa (eye worm)	PHD-finger family protein	0.0025	0.0001	0.0003
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Brugia malayi	Isocitrate dehydrogenase	0.0034	0.0112	0.0274
Schistosoma mansoni	retinoic acid receptor RXR	0.0032	0.0095	0.0114
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0577	1
Echinococcus granulosus	microtubule associated protein 2	0.0694	0.8022	0.9635
Loa Loa (eye worm)	hypothetical protein	0.0114	0.1068	0.2615
Echinococcus multilocularis	geminin	0.072	0.8326	0.8326
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0032	0.0095	0.0095
Brugia malayi	Nuclear hormone receptor-like 1	0.0032	0.0095	0.0232
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0032	0.0095	0.0232
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0577	0.0694
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0054	0.0357	0.467
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0366	0.0895
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0188	0.1954	0.2347
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0116	0.1092	0.2674
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0034	0.0112	0.0112
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0339	0.0829
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0032	0.0095	0.0232
Echinococcus multilocularis	FTZ F1 alpha	0.0114	0.1068	0.1068
Schistosoma mansoni	aldehyde dehydrogenase	0.0072	0.0572	0.0687
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0034	0.0112	0.0112
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0075	0.0605	0.0605
Trypanosoma cruzi	PAB1-binding protein , putative	0.0078	0.0638	1
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0577	0.1097
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0366	0.4084	1
Brugia malayi	ecdysteroid receptor	0.0032	0.0095	0.0232
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0032	0.0095	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0095	0.0232
Loa Loa (eye worm)	bromodomain containing protein	0.0025	0.001	0.0025
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0114	0.1068	0.1283
Plasmodium falciparum	ataxin-2 like protein, putative	0.0078	0.0638	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0577	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0072	0.0572	0.9899
Echinococcus granulosus	zinc finger protein	0.0028	0.0037	0.0045
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0032	0.0095	0.0232
Echinococcus multilocularis	isocitrate dehydrogenase	0.0034	0.0112	0.0112
Onchocerca volvulus		0.0168	0.1724	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.7943 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	1.0418 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)	= 3.9811 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	10 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398]	ChEMBL.	No reference
Potency (functional)	14.1254 uM	PUBCHEM_BIOASSAY: qHTS assay of beta-arrestin-biased ligands of beta2-adrenergic receptor. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID485366, AID485386, AID504448, AID504454, AID504459]	ChEMBL.	No reference
Potency (functional)	20.5962 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)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
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: CHEMBL1410356

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1296337