TDR Targets

Basic information

Technical information

TDR Targets ID: 1309298
Name: 2-(4-ethoxyphenoxy)-N-(4-sulfamoylphenyl)acet amide
MW: 350.39 | Formula: C16H18N2O5S
H donors: 2 H acceptors: 3 LogP: 1.7 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1ccc(cc1)OCC(=O)Nc1ccc(cc1)S(=O)(=O)N
InChi: 1S/C16H18N2O5S/c1-2-22-13-5-7-14(8-6-13)23-11-16(19)18-12-3-9-15(10-4-12)24(17,20)21/h3-10H,2,11H2,1H3,(H,18,19)(H2,17,20,21)
InChiKey: BXLCVOACSVPVAB-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

2-(4-ethoxyphenoxy)-N-(4-sulfamoylphenyl)ethanamide
MLS000627119
N-[4-(aminosulfonyl)phenyl]-2-(4-ethoxyphenoxy)acetamide
SMR000299666
ZINC00957104

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	geminin, DNA replication inhibitor	Starlite/ChEMBL	No references
Homo sapiens	multiple endocrine neoplasia I		No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_133913	All targets in OG5_133913
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)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma japonicum	Menin, putative	Get druggable targets OG5_133913	All targets in OG5_133913
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
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
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
Echinococcus granulosus	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
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 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0058	0.0754	0.0983
Schistosoma mansoni	lipoxygenase	0.0119	0.172	0.2243
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0054	0.0692	0.1649
Echinococcus granulosus	dna polymerase eta	0.0015	0.007	0.0091
Onchocerca volvulus		0.0239	0.363	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Echinococcus multilocularis	transcription factor Dp 1	0.0038	0.0448	0.0585
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.021	0.3171	0.755
Giardia lamblia	Fructose-bisphosphate aldolase	0.0294	0.4501	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0024	0.0212	0.2223
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0058	0.0754	0.0983
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0058	0.0754	0.1238
Echinococcus granulosus	geminin	0.0205	0.3083	0.402
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0119	0.172	0.2243
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0212	1
Onchocerca volvulus		0.0031	0.0327	0.0901
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0494	0.0289
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0119	0.172	0.2243
Trypanosoma brucei	DNA polymerase IV, putative	0.0035	0.0389	0.3879
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0327	0.0426
Echinococcus multilocularis	Polycystic kidney disease protein	0.002	0.0153	0.02
Onchocerca volvulus		0.0035	0.0389	0.1071
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0494	0.0289
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0327	0.0426
Loa Loa (eye worm)	hypothetical protein	0.0084	0.1165	0.2774
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0031	0.0327	0.3529
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0335	0.0797
Brugia malayi	hypothetical protein	0.002	0.0153	0.0365
Trypanosoma brucei	unspecified product	0.0035	0.0389	0.3879
Schistosoma mansoni	lipoxygenase	0.0083	0.1154	0.1505
Schistosoma mansoni	cpg binding protein	0.0037	0.042	0.0548
Loa Loa (eye worm)	doublecortin family protein	0.002	0.0153	0.0365
Schistosoma mansoni	DNA polymerase eta	0.0015	0.007	0.0091
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0714	0.0932
Echinococcus multilocularis	RUN	0.002	0.0153	0.02
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0029	0.0297	0.0388
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsI	0.0641	1	1
Onchocerca volvulus		0.0084	0.1165	0.321
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0015	0.007	0.0091
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0714	0.0932
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Mycobacterium ulcerans	penicillin-binding membrane protein PbpB	0.0639	0.9963	1
Schistosoma mansoni	hypothetical protein	0.0205	0.3083	0.402
Mycobacterium ulcerans	penicillin-binding lipoprotein	0.0132	0.1927	0.1759
Echinococcus multilocularis	cpg binding protein	0.0037	0.042	0.0548
Schistosoma mansoni	hypothetical protein	0.0494	0.7669	1
Echinococcus granulosus	lipoxygenase domain containing protein	0.002	0.0153	0.02
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0714	0.0932
Echinococcus multilocularis	lipoxygenase domain containing protein	0.002	0.0153	0.02
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0066	0.0892	0.1163
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0714	0.0932
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0031	0.0327	0.0426
Mycobacterium leprae	PROBABLE BIFUNCTIONAL PENICILLIN-BINDING PROTEIN 1A/1B PONA1 (MUREIN POLYMERASE) (PBP1): PENICILLIN-INSENSITIVE TRANSGLYCOSYLASE	0.037	0.5704	1
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.007	0.0166
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0335	0.3223
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0103	0.0408
Plasmodium vivax	SET domain protein, putative	0.0031	0.0327	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Schistosoma mansoni	rab6-interacting	0.002	0.0153	0.02
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0066	0.0892	0.2124
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0031	0.0327	0.0426
Schistosoma mansoni	rab6-interacting	0.002	0.0153	0.02
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0144	0.2117	0.1953
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0031	0.0327	0.0426
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0084	0.1165	0.1519
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0103	0.0408
Echinococcus granulosus	cpg binding protein	0.0037	0.042	0.0548
Brugia malayi	Doublecortin family protein	0.002	0.0153	0.0365
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0494	0.516
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Trichomonas vaginalis	conserved hypothetical protein	0.037	0.5704	1
Mycobacterium tuberculosis	Probable penicillin-binding protein PbpA	0.0363	0.5596	1
Mycobacterium ulcerans	bifunctional membrane-associated penicillin-binding protein 1A/1B PonA2	0.0247	0.3762	0.364
Loa Loa (eye worm)	hypothetical protein	0.0015	0.007	0.0166
Echinococcus granulosus	dna polymerase kappa	0.0041	0.0494	0.0644
Echinococcus multilocularis	geminin	0.0205	0.3083	0.402
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0066	0.0892	0.1855
Brugia malayi	hypothetical protein	0.002	0.0153	0.0365
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0084	0.1165	0.2774
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.007	0.0166
Echinococcus multilocularis	dna polymerase eta	0.0015	0.007	0.0091
Treponema pallidum	penicillin-binding protein (pbp-2)	0.037	0.5704	0.5611
Echinococcus granulosus	transcription factor Dp 1	0.0038	0.0448	0.0585
Entamoeba histolytica	hypothetical protein	0.0024	0.0212	0.0321
Mycobacterium leprae	Probable penicillin-binding protein PbpA	0.0363	0.5596	0.9803
Schistosoma mansoni	polycystin 1-related	0.002	0.0153	0.02
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0015	0.007	0.0091
Schistosoma mansoni	hypothetical protein	0.0205	0.3083	0.402
Echinococcus multilocularis	lipoxygenase domain containing protein	0.002	0.0153	0.02
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0066	0.0892	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0012	0.0026	0.0034
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0024	0.0212	0.2223
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0066	0.0892	1
Echinococcus granulosus	dnaJ subfamily B	0.0494	0.7669	1
Schistosoma mansoni	cpg binding protein	0.0035	0.0389	0.0507
Chlamydia trachomatis	transglycolase/transpeptidase	0.0361	0.556	0.5464
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0066	0.0892	0.2124
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0015	0.007	0.0166
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0058	0.0754	0.1795
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0075	0.1022	0.1333
Echinococcus granulosus	L aminoadipate semialdehyde	0.0084	0.1165	0.1519
Trichomonas vaginalis	set domain proteins, putative	0.0239	0.363	0.6018
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0058	0.0754	0.0556
Mycobacterium leprae	PROBABLE BIFUNCTIONAL MEMBRANE-ASSOCIATED PENICILLIN-BINDING PROTEIN 1A/1B PONA2 (MUREIN POLYMERASE) [INCLUDES: PENICILLIN-INSEN	0.0247	0.3762	0.6463
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0389	0.0925
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0714	0.1701
Schistosoma mansoni	glutaminase	0.0275	0.42	0.5476
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0066	0.0892	0.1163
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0144	0.2117	0.3704
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0015	0.007	0.0091
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0714	0.0932
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0066	0.0892	1
Mycobacterium ulcerans	penicillin-binding protein PbpA	0.0363	0.5596	0.5522
Brugia malayi	Pre-SET motif family protein	0.021	0.3171	0.755
Mycobacterium tuberculosis	Possible penicillin-binding lipoprotein	0.0132	0.1927	0.336
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0327	0.0779
Echinococcus granulosus	RUN	0.002	0.0153	0.02
Echinococcus multilocularis	dna polymerase kappa	0.0041	0.0494	0.0644
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0494	0.516
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0066	0.0892	0.1163
Loa Loa (eye worm)	hypothetical protein	0.002	0.0153	0.0365
Schistosoma mansoni	hypothetical protein	0.002	0.0153	0.02
Echinococcus multilocularis	dnaJ subfamily B	0.0494	0.7669	1
Loa Loa (eye worm)	glutaminase 2	0.0275	0.42	1
Mycobacterium tuberculosis	Probable bifunctional penicillin-binding protein 1A/1B PonA1 (murein polymerase) (PBP1): penicillin-insensitive transglycosylase	0.0123	0.1782	0.3097
Echinococcus granulosus	Polycystic kidney disease protein	0.002	0.0153	0.02
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0327	0.0426
Schistosoma mansoni	cpg binding protein	0.0037	0.042	0.0548
Onchocerca volvulus		0.002	0.0153	0.0422
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.4501	0.7691
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0058	0.0754	0.0556
Loa Loa (eye worm)	hypothetical protein	0.002	0.0153	0.0365
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0024	0.0212	0.0257
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0066	0.0892	1
Mycobacterium ulcerans	glutaminase	0.0275	0.42	0.409
Echinococcus granulosus	lipoxygenase domain containing protein	0.002	0.0153	0.02
Treponema pallidum	penicillin-binding protein (pbp-3)	0.0639	0.9963	0.9962
Leishmania major	phosphopantetheinyl transferase-like protein	0.0024	0.0212	0.1729
Mycobacterium leprae	POSSIBLE PENICILLIN-BINDING LIPOPROTEIN	0.0132	0.1927	0.3122
Treponema pallidum	fructose-bisphosphate aldolase	0.0294	0.4501	0.4382
Mycobacterium ulcerans	bifunctional penicillin-binding protein 1A/1B PonA1	0.037	0.5704	0.5632
Schistosoma mansoni	loxhd1	0.002	0.0153	0.02
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Onchocerca volvulus		0.002	0.0153	0.0422
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0012	0.0026	0.0034
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0144	0.2117	0.3468
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0389	0.0925
Trypanosoma brucei	hypothetical protein, conserved	0.0024	0.0212	0.1729
Mycobacterium leprae	Probable penicillin-binding membrane protein PbpB	0.0229	0.3472	0.5935
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0021	0.0175	0.019
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0335	0.3223
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0714	0.1701
Brugia malayi	polk-prov protein	0.0031	0.0335	0.0797
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0084	0.1165	0.1519
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0294	0.4501	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0294	0.4501	1
Brugia malayi	F/Y-rich N-terminus family protein	0.0012	0.0024	0.0058
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0015	0.007	0.0091
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0714	0.0932
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0058	0.0754	0.8323
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0067	0.0898	1
Brugia malayi	glutaminase DH11.1	0.0275	0.42	1
Loa Loa (eye worm)	histone methyltransferase	0.0012	0.0026	0.0063
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0021	0.0175	0.128
Trypanosoma brucei	DNA polymerase kappa, putative	0.0021	0.0175	0.128
Brugia malayi	Pre-SET motif family protein	0.0031	0.0327	0.0779
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0494	0.516
Leishmania major	DNA polymerase kappa, putative	0.0021	0.0175	0.128
Mycobacterium tuberculosis	Probable penicillin-binding membrane protein PbpB	0.0229	0.3472	0.6156
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0103	0.0408
Treponema pallidum	penicillin-binding protein (pbp-1)	0.0641	1	1
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0212	0.3368
Mycobacterium tuberculosis	Probable bifunctional membrane-associated penicillin-binding protein 1A/1B PonA2 (murein polymerase) [includes: penicillin-insen	0.0247	0.3762	0.668
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0058	0.0754	0.0983
Echinococcus granulosus	histone lysine methyltransferase setb	0.0031	0.0327	0.0426
Trichomonas vaginalis	glutaminase, putative	0.0275	0.42	0.7113
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0714	0.0932
Loa Loa (eye worm)	glutaminase	0.0275	0.42	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.8913 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)	1.8526 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)	16.3601 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)	= 17.7828 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	18.3564 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)	79.4328 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)	89.1251 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (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: CHEMBL1424515

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1309298