TDR Targets

Basic information

Technical information

TDR Targets ID: 670839
Name: 2-methoxy-N-(3-nitrophenyl)-2-phenylacetamide
MW: 286.283 | Formula: C15H14N2O4
H donors: 1 H acceptors: 3 LogP: 2.51 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COC(c1ccccc1)C(=O)Nc1cccc(c1)[N+](=O)[O-]
InChi: 1S/C15H14N2O4/c1-21-14(11-6-3-2-4-7-11)15(18)16-12-8-5-9-13(10-12)17(19)20/h2-10,14H,1H3,(H,16,18)
InChiKey: RAEASANGRRPXFQ-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-methoxy-N-(3-nitrophenyl)-2-phenyl-acetamide
2-methoxy-N-(3-nitrophenyl)-2-phenyl-ethanamide
MLS000677516
SMR000271692

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	muscleblind-like splicing regulator 1	Starlite/ChEMBL	No references
Homo sapiens	aldehyde dehydrogenase 1 family, member A1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
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
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative	Get druggable targets OG5_126638	All targets in OG5_126638
Brugia malayi	Muscleblind-like protein	Get druggable targets OG5_132352	All targets in OG5_132352
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
Toxoplasma gondii	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
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
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132352	All targets in OG5_132352
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132352	All targets in OG5_132352
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	muscleblind protein	Get druggable targets OG5_132352	All targets in OG5_132352
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania braziliensis	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Retinal dehydrogenase 1, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase X, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania donovani	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	muscleblind protein 1	Get druggable targets OG5_132352	All targets in OG5_132352
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	muscleblind protein	Get druggable targets OG5_132352	All targets in OG5_132352
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania mexicana	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
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	hypothetical protein	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania infantum	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Mycobacterium tuberculosis	Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1	aldehyde dehydrogenase 1 family, member A1	501 aa	456 aa	33.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1282	0.239
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0035	0.0622	0.0622
Echinococcus multilocularis	muscleblind protein 1	0.018	0.5363	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0622	1
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0243	0.0341
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0622	0.0873
Mycobacterium ulcerans	lipase LipD	0.0035	0.0622	0.0622
Brugia malayi	Muscleblind-like protein	0.018	0.5363	0.7537
Mycobacterium tuberculosis	Probable oxidoreductase	0.0117	0.3282	0.3282
Brugia malayi	beta-lactamase	0.0035	0.0622	0.0874
Mycobacterium tuberculosis	Probable reductase	0.0105	0.29	0.29
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1282	0.1801
Echinococcus granulosus	smad	0.0016	0.0001	0.0001
Trypanosoma cruzi	trypanothione reductase, putative	0.0046	0.098	0.5746
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0622	0.146
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0114	0.1837
Echinococcus multilocularis	transcription factor Dp 1	0.0039	0.0768	0.1432
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0114	0.1837
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0001	0.0002
Mycobacterium tuberculosis	Probable dehydrogenase	0.0105	0.29	0.29
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0068	0.1705	0.508
Trichomonas vaginalis	esterase, putative	0.0035	0.0622	1
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0035	0.0622	0.0622
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0622	0.146
Toxoplasma gondii	aldehyde dehydrogenase	0.0073	0.1872	0.1872
Toxoplasma gondii	exonuclease III APE	0.0019	0.0114	0.0114
Schistosoma mansoni	Smad4	0.0016	0.0001	0.0002
Mycobacterium tuberculosis	Probable lipase LipE	0.0035	0.0622	0.0622
Schistosoma mansoni	smad	0.0016	0.0001	0.0002
Echinococcus multilocularis	muscleblind protein	0.018	0.5363	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0114	0.067
Leishmania major	hypothetical protein, conserved	0.0035	0.0622	0.1853
Toxoplasma gondii	ABC1 family protein	0.0035	0.0622	0.0622
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0622	0.0622
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0073	0.1872	0.349
Loa Loa (eye worm)	hypothetical protein	0.018	0.5363	0.7537
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0114	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0622	0.0622
Echinococcus granulosus	thioredoxin glutathione reductase	0.0046	0.098	0.1827
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1282	0.3008
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.1705	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0114	0.0114
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0622	0.3648
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0105	0.29	0.29
Echinococcus granulosus	Smad4	0.0016	0.0001	0.0001
Onchocerca volvulus		0.0035	0.0622	0.5
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0068	0.1705	0.2395
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0114	1
Onchocerca volvulus		0.0035	0.0622	0.5
Loa Loa (eye worm)	MH2 domain-containing protein	0.0234	0.7116	1
Mycobacterium tuberculosis	Dihydropteroate synthase 2 FolP2 (DHPS 2) (dihydropteroate pyrophosphorylase 2)	0.0119	0.3356	0.3356
Mycobacterium tuberculosis	Probable esterase LipL	0.0035	0.0622	0.0622
Mycobacterium ulcerans	beta-lactamase	0.0035	0.0622	0.0622
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0016	0.0001	0.0001
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0016	0.0001	0.0001
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0622	1
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0622	0.0873
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0114	0.0114
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.1872	0.4392
Plasmodium falciparum	glutathione reductase	0.0046	0.098	0.098
Plasmodium vivax	glutathione reductase, putative	0.0046	0.098	0.098
Schistosoma mansoni	ap endonuclease	0.0019	0.0114	0.0268
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0622	0.0874
Schistosoma mansoni	ap endonuclease	0.0019	0.0114	0.0268
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0114	0.067
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0046	0.098	0.098
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.1872	0.4392
Echinococcus multilocularis	smad	0.0016	0.0001	0.0001
Mycobacterium tuberculosis	Probable lipase LipD	0.0035	0.0622	0.0622
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0105	0.29	0.29
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0622	0.3648
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0068	0.1705	0.2396
Brugia malayi	beta-lactamase family protein	0.0035	0.0622	0.0874
Echinococcus granulosus	muscleblind protein	0.018	0.5363	1
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0114	0.034
Plasmodium vivax	thioredoxin reductase, putative	0.0046	0.098	0.098
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1282	0.3008
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.0114	1
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0073	0.1872	0.349
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0035	0.0622	0.0622
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0622	1
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0114	0.0114
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0035	0.0622	0.0622
Echinococcus multilocularis	Smad4	0.0016	0.0001	0.0001
Toxoplasma gondii	thioredoxin reductase	0.0046	0.098	0.098
Plasmodium falciparum	thioredoxin reductase	0.0046	0.098	0.098
Trypanosoma brucei	trypanothione reductase	0.0046	0.098	0.5746
Mycobacterium ulcerans	esterase/lipase LipP	0.0035	0.0622	0.0622
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0073	0.1872	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Brugia malayi	beta-lactamase family protein	0.0035	0.0622	0.0874
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0105	0.29	0.2429
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.0622	0.116
Mycobacterium leprae	PROBABLE DIHYDROPTEROATE SYNTHASE 2 FOLP2 (DHPS 2) (Dihydropteroate pyrophosphorylase 2)	0.0119	0.3356	0.2915
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0073	0.1872	0.5577
Mycobacterium ulcerans	dihydropteroate synthase 2 FolP2	0.0119	0.3356	0.3356
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0114	0.016
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.1872	0.1872
Brugia malayi	Thioredoxin reductase	0.0046	0.098	0.1377
Brugia malayi	MH1 domain containing protein	0.0016	0.0001	0.0001
Plasmodium falciparum	hydroxymethyldihydropterin pyrophosphokinase-dihydropteroate synthase	0.0323	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1282	0.239
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.1705	1
Mycobacterium ulcerans	B12-dependent methionine synthase	0.0119	0.3356	0.3356
Echinococcus granulosus	mothers against decapentaplegic 5	0.0016	0.0001	0.0001
Leishmania major	trypanothione reductase	0.0046	0.098	0.2919
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0117	0.3282	0.2836
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0068	0.1705	0.4001
Loa Loa (eye worm)	glutathione reductase	0.0046	0.098	0.1376
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1282	0.3008
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1282	0.1801
Brugia malayi	glutathione reductase	0.0046	0.098	0.1377
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0046	0.098	0.1827
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0622	0.0622
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0114	0.0161
Brugia malayi	MH2 domain containing protein	0.0016	0.0001	0.0001
Plasmodium vivax	hydroxymethylpterin pyrophosphokinase-dihydropteroate synthetase, putative	0.0323	1	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0114	0.067
Loa Loa (eye worm)	cytochrome P450 family protein	0.0023	0.0243	0.034
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0622	1
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0622	0.0622
Mycobacterium tuberculosis	Probable hydrolase	0.0035	0.0622	0.0622
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0117	0.3282	0.3282
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.1705	1
Brugia malayi	Smad1	0.0016	0.0001	0.0001
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0001	0.0002
Mycobacterium leprae	Probable 5-methyltetrahydrofolate--homocystein methyltransferase MetH (Methionine synthase, vitamin-B12 dependent isozyme) (MS)	0.0119	0.3356	0.2915
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0016	0.0001	0.0001
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0105	0.29	0.29
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0224	0.6773	0.6773
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0114	0.0213
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0068	0.1705	0.3179
Echinococcus granulosus	transcription factor Dp 1	0.0039	0.0768	0.1432
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0114	1
Mycobacterium ulcerans	hypothetical protein	0.0035	0.0622	0.0622
Brugia malayi	MH2 domain containing protein	0.0016	0.0001	0.0001
Leishmania major	methionine synthase, putative	0.0119	0.3356	1
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0068	0.1705	0.3179
Mycobacterium tuberculosis	Dihydropteroate synthase 1 FolP (DHPS 1) (dihydropteroate pyrophosphorylase 1) (dihydropteroate diphosphorylase 1)	0.0323	1	1
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.0622	0.116
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.1872	0.1872
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0117	0.3282	0.3282
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0105	0.29	0.29
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1282	0.239
Brugia malayi	MH1 domain containing protein	0.0016	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Loa Loa (eye worm)	thioredoxin reductase	0.0046	0.098	0.1376
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0622	0.0873
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.1872	0.1872
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0068	0.1705	1
Mycobacterium leprae	Probable dihydropteroate synthase 1 FolP1 (DHPS 1) (dihydropteroate pyrophosphorylase 1) (dihydropteroate dipyrophosphorylase 1)	0.0323	1	1
Loa Loa (eye worm)	hypothetical protein	0.018	0.5363	0.7537
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0001	0.0002
Loa Loa (eye worm)	transcription factor SMAD2	0.0234	0.7116	1
Onchocerca volvulus		0.0035	0.0622	0.5
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0114	0.0213
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0622	1
Trypanosoma brucei	hypothetical protein, conserved	0.0035	0.0622	0.3648
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0016	0.0001	0.0002
Toxoplasma gondii	dihydropteroate synthase	0.0323	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1282	0.239
Brugia malayi	MH2 domain containing protein	0.0234	0.7116	1
Mycobacterium ulcerans	dihydropteroate synthase 1 FolP1	0.0323	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	5.6234 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 (binding)	15.8489 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 19.9526 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (functional)	20.7865 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)	35.4813 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference

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.

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: CHEMBL1585032
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Bibliographic References

No literature references available for this target.

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Detailed information for compound 670839