TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 414.99 | Formula: C20H31ClN2O3S
H donors: 1 H acceptors: 2 LogP: 5.47 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)c1c(NC(=O)C2CCCCC2)sc2c1CCN(C2)C(C)C.Cl
InChi: 1S/C20H30N2O3S.ClH/c1-4-25-20(24)17-15-10-11-22(13(2)3)12-16(15)26-19(17)21-18(23)14-8-6-5-7-9-14;/h13-14H,4-12H2,1-3H3,(H,21,23);1H
InChiKey: MUBXPFGXBOSCAM-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	geminin, DNA replication inhibitor	Starlite/ChEMBL	No references
Homo sapiens	K(lysine) acetyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	isocitrate dehydrogenase 1 (NADP+), soluble	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
Giardia lamblia	Histone acetyltransferase GCN5	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
Theileria parva	isocitrate dehydrogenase (NADP+), putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma congolense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma brucei	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	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
Echinococcus multilocularis	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	Get druggable targets OG5_127781	All targets in OG5_127781
Neospora caninum	hypothetical protein	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium berghei	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Brugia malayi	Isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	C terminus of cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Neospora caninum	Bromodomain containing protein, related	Get druggable targets OG5_127781	All targets in OG5_127781
Plasmodium knowlesi	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania mexicana	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Babesia bovis	histone acetyltransferase	Get druggable targets OG5_127781	All targets in OG5_127781
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Plasmodium yoelii	isocitrate dehydrogenase, NADP-dependent, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K06062 p300/CBP-associated factor, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania braziliensis	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus granulosus	histone acetyltransferase KAT2B	Get druggable targets OG5_127781	All targets in OG5_127781
Trypanosoma cruzi	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Theileria parva	histone acetyltransferase Gcn5, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Toxoplasma gondii	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	Get druggable targets OG5_127057	All targets in OG5_127057
Cryptosporidium parvum	GCN5 like acetylase + bromodomain	Get druggable targets OG5_127781	All targets in OG5_127781
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania donovani	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	Get druggable targets OG5_127781	All targets in OG5_127781
Trypanosoma congolense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	Mitochondrial NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	N terminus of cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Babesia bovis	isocitrate dehydrogenase, NADP-dependent family protein	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	Get druggable targets OG5_127781	All targets in OG5_127781
Cryptosporidium hominis	histone acetyltransferase	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
Brugia malayi	acetyltransferase, GNAT family protein	Get druggable targets OG5_127781	All targets in OG5_127781
Trypanosoma brucei gambiense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium yoelii	isocitrate dehydrogenase, NADP-dependent	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	Get druggable targets OG5_127057	All targets in OG5_127057
Neospora caninum	hypothetical protein	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
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Toxoplasma gondii	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Candida albicans	cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma brucei gambiense	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trichomonas vaginalis	bromodomain-containing protein, putative	Get druggable targets OG5_127781	All targets in OG5_127781
Neospora caninum	Isocitrate dehydrogenase-like protein, related	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	Mitochondrial NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania infantum	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Brugia malayi	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Loa Loa (eye worm)	acetyltransferase	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
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium yoelii	histone acetyltransferase GCN5-related	Get druggable targets OG5_127781	All targets in OG5_127781
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Plasmodium falciparum	histone acetyltransferase GCN5	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

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Brugia malayi	Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X	geminin, DNA replication inhibitor	209 aa	176 aa	27.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1975	0.1949
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1881	0.2166
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1975	0.1975
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0021	0.0114	0.0114
Loa Loa (eye worm)	bromodomain containing protein	0.0026	0.0384	0.0412
Brugia malayi	Bromodomain containing protein	0.0095	0.4103	0.4772
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0021	0.0114	0.0082
Schistosoma mansoni	serine/threonine protein kinase	0.0095	0.4088	0.4088
Leishmania major	hypothetical protein, conserved	0.0027	0.0475	0.1161
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0054	0.1926	1
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0035	0.087	0.0981
Schistosoma mansoni	bromodomain containing protein	0.0081	0.3343	0.3343
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Schistosoma mansoni	hypothetical protein	0.0205	1	1
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0019	0.0032	0.0079
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0021	0.0114	0.0114
Schistosoma mansoni	hypothetical protein	0.0025	0.0346	0.0346
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0021	0.0114	0.0082
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2573	0.2573
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0475	0.2929
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0095	0.4088	0.4754
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0076	0.3111	0.3088
Echinococcus granulosus	histone lysine methyltransferase setb	0.0021	0.0114	0.0082
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0475	0.1161
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0095	0.4088	0.4069
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0027	0.047	0.0439
Loa Loa (eye worm)	PHD-finger family protein	0.0025	0.0346	0.0368
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0035	0.087	0.084
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2573	0.2573
Brugia malayi	RNA binding protein	0.0066	0.2573	0.2978
Brugia malayi	Bromodomain containing protein	0.0051	0.1722	0.1981
Brugia malayi	acetyltransferase, GNAT family protein	0.0178	0.8564	1
Schistosoma mansoni	hypothetical protein	0.0035	0.087	0.087
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.011	0.4893	0.5697
Trypanosoma cruzi	polo-like protein kinase, putative	0.0095	0.4088	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0129	0.5957	0.6944
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0475	0.1161
Plasmodium falciparum	histone acetyltransferase GCN5	0.0047	0.1542	1
Trypanosoma cruzi	polo-like protein kinase, putative	0.0095	0.4088	1
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0095	0.4088	1
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0054	0.1926	1
Echinococcus multilocularis	geminin	0.0205	1	1
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0054	0.1926	0.1573
Echinococcus multilocularis	zinc finger protein	0.0028	0.0508	0.0477
Brugia malayi	hypothetical protein	0.0027	0.0475	0.0518
Loa Loa (eye worm)	hypothetical protein	0.0056	0.2004	0.2312
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Schistosoma mansoni	hypothetical protein	0.0075	0.3031	0.3031
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0114	0.0095
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0019	0.0032	0.0079
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0095	0.4088	0.5
Echinococcus multilocularis	GPCR, family 2	0.0035	0.087	0.084
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1975	0.2277
Schistosoma mansoni	hypothetical protein	0.0035	0.087	0.087
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0019	0.0032	0.0079
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1975	0.2277
Brugia malayi	Latrophilin receptor protein 2	0.0035	0.087	0.0981
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0475	0.2335
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0178	0.8564	0.8564
Loa Loa (eye worm)	hypothetical protein	0.0085	0.3595	0.4176
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0019	0.0032	0.5
Loa Loa (eye worm)	hypothetical protein	0.011	0.4893	0.5697
Brugia malayi	latrophilin 2 splice variant baaae	0.0075	0.3031	0.3514
Trypanosoma brucei	polo-like protein kinase	0.0095	0.4088	1
Loa Loa (eye worm)	TAR-binding protein	0.0066	0.2573	0.2978
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0019	0.0032	0.0079
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0095	0.4088	0.4069
Brugia malayi	PHD-finger family protein	0.0034	0.0854	0.0963
Echinococcus granulosus	histone acetyltransferase KAT2B	0.017	0.8146	0.814
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0035	0.087	0.0981
Loa Loa (eye worm)	MH2 domain-containing protein	0.0129	0.5957	0.6944
Echinococcus granulosus	tar DNA binding protein	0.0066	0.2573	0.2548
Loa Loa (eye worm)	acetyltransferase	0.0178	0.8564	1
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2573	0.2573
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1975	0.1975
Schistosoma mansoni	zinc finger protein	0.0028	0.0508	0.0508
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0054	0.1926	0.1573
Echinococcus multilocularis	tar DNA binding protein	0.0066	0.2573	0.2548
Echinococcus granulosus	fetal alzheimer antigen falz	0.0027	0.047	0.0439
Loa Loa (eye worm)	hypothetical protein	0.0046	0.1497	0.1716
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0035	0.087	0.084
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1975	0.1949
Brugia malayi	RNA recognition motif domain containing protein	0.0066	0.2573	0.2978
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0475	0.0518
Loa Loa (eye worm)	hypothetical protein	0.0035	0.087	0.0981
Brugia malayi	serine/threonine-protein kinase plk-2	0.0095	0.4088	0.4754
Echinococcus granulosus	zinc finger protein	0.0028	0.0508	0.0477
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0043	0.1338	0.131
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0019	0.0032	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0075	0.3031	0.3514
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0035	0.087	0.084
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1975	0.1949
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0021	0.0114	0.0114
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0043	0.1338	0.131
Trypanosoma brucei	PAB1-binding protein , putative	0.0027	0.0475	0.1161
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0475	0.2929
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0019	0.0032	0.0032
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0035	0.087	0.084
Echinococcus granulosus	GPCR family 2	0.0035	0.087	0.084
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.011	0.4893	0.5697
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0027	0.047	0.047
Loa Loa (eye worm)	RNA binding protein	0.0066	0.2573	0.2978
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0054	0.1926	1
Schistosoma mansoni	hypothetical protein	0.0035	0.087	0.087
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0066	0.2573	0.2978
Schistosoma mansoni	hypothetical protein	0.0205	1	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1975	0.1975
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0178	0.8564	0.8559
Brugia malayi	TAR-binding protein	0.0066	0.2573	0.2978
Schistosoma mansoni	kinase	0.0048	0.159	0.159
Brugia malayi	MH2 domain containing protein	0.0129	0.5957	0.6944
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0054	0.1926	0.19
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0076	0.3111	0.3088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1975	0.1949
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.011	0.4893	0.5697
Plasmodium vivax	ataxin-2 like protein, putative	0.0027	0.0475	0.2335
Trichomonas vaginalis	CAMK family protein kinase	0.0095	0.4088	1
Schistosoma mansoni	hypothetical protein	0.0035	0.087	0.087
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0021	0.0114	0.0082
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0021	0.0114	0.0114
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2573	0.2573
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2573	0.2573
Giardia lamblia	Kinase, PLK	0.0095	0.4088	1
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0095	0.4088	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.7079 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398]	ChEMBL.	No reference
Potency (functional)	1 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)	5.1735 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.8048 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)	11.5821 uM	PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	13.1154 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	14.1254 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	23.7781 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (binding)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)]	ChEMBL.	No reference
Potency (functional)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ]	ChEMBL.	No reference
Potency (functional)	100 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	1778.2794 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the Phosphatase Activity of Eya2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488939]	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: CHEMBL1590034

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1454524