TDR Targets

Basic information

Technical information

TDR Targets ID: 1424649
Name: 7-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethoxy ]-4-phenylchromen-2-one
MW: 393.432 | Formula: C23H23NO5
H donors: 0 H acceptors: 2 LogP: 3.08 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CC1OC(C)CN(C1)C(=O)COc1ccc2c(c1)oc(=O)cc2c1ccccc1
InChi: 1S/C23H23NO5/c1-15-12-24(13-16(2)28-15)22(25)14-27-18-8-9-19-20(17-6-4-3-5-7-17)11-23(26)29-21(19)10-18/h3-11,15-16H,12-14H2,1-2H3
InChiKey: OCVJEGKGHFRTFA-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

7-[2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethoxy]-4-phenyl-chromen-2-one
7-[2-(2,6-dimethyl-4-morpholinyl)-2-oxoethoxy]-4-phenyl-2-chromenone
7-[2-(2,6-dimethylmorpholin-4-yl)-2-keto-ethoxy]-4-phenyl-coumarin
T5600947

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	APEX nuclease (multifunctional DNA repair enzyme) 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania mexicana	apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Toxoplasma gondii	exonuclease III APE	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania braziliensis	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Theileria parva	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei gambiense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10772 AP endonuclease 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	Get druggable targets OG5_126768	All targets in OG5_126768
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium yoelii	putative AP endonuclease-related	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania infantum	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania donovani	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium berghei	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium parvum	conserved hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Treponema pallidum	exodeoxyribonuclease (exoA)	Get druggable targets OG5_126768	All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi	exonuclease III	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10771 AP endonuclease 1, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Entamoeba histolytica	exodeoxyribonuclease III, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma congolense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium hominis	dna-(apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium knowlesi	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768

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
Trypanosoma cruzi	PAB1-binding protein , putative	0.0021	0.0069	0.1968
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0251	0.1658
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0014	0.0017	0.0052
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.006	0.0366	1
Mycobacterium ulcerans	hypothetical protein	0.006	0.0366	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0203	0.1441	0.4344
Loa Loa (eye worm)	hypothetical protein	0.006	0.0366	0.2414
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0043	0.0233	0.6071
Mycobacterium ulcerans	acyl-CoA synthetase	0.006	0.0366	1
Loa Loa (eye worm)	hypothetical protein	0.0196	0.1387	0.9151
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0069	0.0457
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Loa Loa (eye worm)	hypothetical protein	0.0013	0.001	0.0067
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0203	0.1441	0.1441
Trypanosoma cruzi	cysteine peptidase, putative	0.0053	0.0311	1
Loa Loa (eye worm)	hypothetical protein	0.0013	0.001	0.0067
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0213	0.1516	1
Echinococcus multilocularis	lysine specific demethylase 5A	0.0049	0.0278	0.0278
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Brugia malayi	hypothetical protein	0.0196	0.1387	0.9151
Entamoeba histolytica	hypothetical protein	0.0035	0.0174	0.4493
Schistosoma mansoni	aldehyde dehydrogenase	0.005	0.0291	0.2022
Entamoeba histolytica	hypothetical protein	0.0035	0.0174	0.4493
Loa Loa (eye worm)	jmjC domain-containing protein	0.0013	0.001	0.0067
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0014	0.0017	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0046	0.0302
Loa Loa (eye worm)	hypothetical protein	0.0013	0.001	0.0067
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0174	0.0174
Schistosoma mansoni	ap endonuclease	0.0023	0.0083	0.0579
Onchocerca volvulus		0.0018	0.0046	0.0475
Mycobacterium tuberculosis	Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase)	0.0018	0.0046	0.0546
Brugia malayi	Papain family cysteine protease containing protein	0.0014	0.0017	0.0114
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0018	0.0046	0.0546
Plasmodium vivax	ataxin-2 like protein, putative	0.0021	0.0069	0.2451
Loa Loa (eye worm)	hypothetical protein	0.006	0.0366	0.2414
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.005	0.0291	0.0879
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Onchocerca volvulus	Cathepsin L homolog	0.0014	0.0017	0.0179
Trypanosoma brucei	long-chain-fatty-acid-CoA ligase, putative	0.0018	0.0046	0.1187
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0014	0.0017	0.0114
Brugia malayi	jmjC domain containing protein	0.0049	0.0278	0.1833
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0203	0.1441	1
Trypanosoma cruzi	long-chain-fatty-acid-CoA ligase, putative	0.0018	0.0046	0.1187
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0018	0.0046	0.0546
Loa Loa (eye worm)	TAR-binding protein	0.0052	0.0306	0.2019
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0083	0.3036
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Trypanosoma cruzi	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1187
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Leishmania major	hypothetical protein, conserved	0.0021	0.0069	0.1662
Loa Loa (eye worm)	oxidoreductase	0.0018	0.0046	0.0302
Brugia malayi	AMP-binding enzyme family protein	0.006	0.0366	0.2414
Trypanosoma cruzi	PAB1-binding protein , putative	0.0021	0.0069	0.1968
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0013	0.001	0.0031
Leishmania major	4-coumarate:coa ligase-like protein	0.006	0.0366	1
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0049	0.0278	0.0278
Mycobacterium tuberculosis	Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0046	0.0546
Trypanosoma cruzi	long-chain-fatty-acid-CoA ligase, putative	0.0018	0.0046	0.1187
Plasmodium falciparum	ataxin-2 like protein, putative	0.0021	0.0069	0.2451
Echinococcus multilocularis	geminin	0.014	0.0964	0.0964
Schistosoma mansoni	jumonji domain containing protein	0.0049	0.0278	0.1928
Plasmodium vivax	vivapain-2	0.0014	0.0017	0.0292
Schistosoma mansoni	tar DNA-binding protein	0.0052	0.0306	0.2124
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Brugia malayi	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Toxoplasma gondii	propionate-CoA ligase	0.0018	0.0046	0.1268
Mycobacterium ulcerans	aldehyde dehydrogenase	0.005	0.0291	0.7674
Trypanosoma cruzi	cruzipain precursor, putative	0.0053	0.0311	1
Schistosoma mansoni	acetyl-CoA synthetase	0.0018	0.0046	0.0318
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0014	0.0017	0.0292
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0083	0.3036
Schistosoma mansoni	hypothetical protein	0.0035	0.0174	0.1207
Echinococcus multilocularis	lysine specific demethylase 6a	0.0013	0.001	0.001
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0046	0.0546
Leishmania major	cathepsin L-like protease	0.0014	0.0017	0.0198
Brugia malayi	jmjC domain containing protein	0.0013	0.001	0.0067
Mycobacterium ulcerans	acyl-CoA synthetase	0.006	0.0366	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0017	0.0114
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0046	0.0302
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Entamoeba histolytica	acyl-coA synthetase, putative	0.006	0.0366	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0023	0.0083	0.1174
Loa Loa (eye worm)	fibroinase	0.0014	0.0017	0.0114
Echinococcus granulosus	JmjC domain containing protein 4	0.0013	0.001	0.0031
Echinococcus granulosus	lysine specific demethylase 6a	0.0013	0.001	0.0031
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.006	0.0366	1
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.005	0.0291	0.0291
Brugia malayi	RNA binding protein	0.0052	0.0306	0.2019
Brugia malayi	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Brugia malayi	exodeoxyribonuclease III family protein	0.0023	0.0083	0.055
Schistosoma mansoni	phd/f-box containing protein	0.0013	0.001	0.0071
Echinococcus granulosus	survival motor neuron protein 1	0.0196	0.1387	0.4182
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0049	0.0278	0.1928
Brugia malayi	hypothetical protein	0.0035	0.0174	0.1147
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0013	0.001	0.0071
Brugia malayi	acetyl-Coenzyme A synthetase 2	0.0018	0.0046	0.0302
Entamoeba histolytica	acyl-CoA synthetase, putative	0.006	0.0366	1
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.006	0.0366	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0053	0.0311	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0203	0.1441	0.4344
Onchocerca volvulus		0.0018	0.0046	0.0475
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Echinococcus multilocularis	tar DNA binding protein	0.0052	0.0306	0.0306
Onchocerca volvulus		0.004	0.0214	0.2214
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0045	0.0251	0.6421
Echinococcus granulosus	phd:f box containing protein	0.0013	0.001	0.0031
Echinococcus multilocularis	cathepsin L cysteine protease	0.0014	0.0017	0.0017
Schistosoma mansoni	survival motor neuron protein	0.004	0.0214	0.1482
Onchocerca volvulus		0.0018	0.0046	0.0475
Trypanosoma brucei	PAB1-binding protein , putative	0.0021	0.0069	0.1968
Leishmania major	cysteine peptidase A (CPA)	0.0014	0.0017	0.0198
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Echinococcus multilocularis	cysteine protease	0.0014	0.0017	0.0017
Entamoeba histolytica	hypothetical protein	0.0035	0.0174	0.4493
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.0083	0.0442
Loa Loa (eye worm)	jmjC domain-containing protein	0.0049	0.0278	0.1833
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.006	0.0366	1
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0213	0.1516	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0251	0.1658
Loa Loa (eye worm)	jmjC domain-containing protein	0.0013	0.001	0.0067
Leishmania major	cathepsin L-like protease	0.0014	0.0017	0.0198
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0023	0.0083	0.0083
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0014	0.0017	0.0052
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0043	0.0233	0.6071
Schistosoma mansoni	hypothetical protein	0.014	0.0964	0.6694
Schistosoma mansoni	tar DNA-binding protein	0.0052	0.0306	0.2124
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0014	0.0017	0.0017
Onchocerca volvulus	Cathepsin L homolog	0.0014	0.0017	0.0179
Leishmania major	long-chain-fatty-acid-CoA ligase, putative	0.0018	0.0046	0.1003
Onchocerca volvulus		0.0014	0.0017	0.0179
Trypanosoma cruzi	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1187
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0046	0.0546
Loa Loa (eye worm)	cysteine protease	0.0014	0.0017	0.0114
Leishmania major	cathepsin L-like protease	0.0014	0.0017	0.0198
Schistosoma mansoni	cathepsin F (C01 family)	0.0014	0.0017	0.012
Onchocerca volvulus		0.0014	0.0017	0.0179
Schistosoma mansoni	tar DNA-binding protein	0.0052	0.0306	0.2124
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Onchocerca volvulus	Glucosylceramidase homolog	0.014	0.0964	1
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0018	0.0046	0.0546
Plasmodium vivax	acyl-CoA synthetase, putative	0.0045	0.0251	1
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.005	0.0291	0.7801
Loa Loa (eye worm)	RNA binding protein	0.0052	0.0306	0.2019
Leishmania major	cathepsin L-like protease	0.0014	0.0017	0.0198
Schistosoma mansoni	protein phosphatase 2C	0.0013	0.001	0.0071
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0043	0.0233	0.6071
Echinococcus multilocularis	cathepsin L cysteine protease	0.0014	0.0017	0.0017
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0045	0.0251	0.6617
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0203	0.1441	0.1441
Brugia malayi	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0148	0.1021	0.67
Loa Loa (eye worm)	ctsf protein	0.0014	0.0017	0.0114
Toxoplasma gondii	AMP-binding enzyme domain-containing protein	0.0018	0.0046	0.1268
Toxoplasma gondii	exonuclease III APE	0.0023	0.0083	0.2603
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0023	0.0083	0.0251
Echinococcus multilocularis	cysteine protease	0.0014	0.0017	0.0017
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0018	0.0046	0.0546
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0023	0.0083	0.1656
Schistosoma mansoni	tar DNA-binding protein	0.0052	0.0306	0.2124
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Echinococcus granulosus	tar DNA binding protein	0.0052	0.0306	0.0923
Trichomonas vaginalis	glucosylceramidase, putative	0.0148	0.1021	0.67
Toxoplasma gondii	LsmAD domain-containing protein	0.0021	0.0069	0.2102
Schistosoma mansoni	tar DNA-binding protein	0.0052	0.0306	0.2124
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.0083	0.0442
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.006	0.0366	1
Entamoeba histolytica	hypothetical protein	0.0035	0.0174	0.4493
Echinococcus multilocularis	survival motor neuron protein 1	0.0196	0.1387	0.1387
Onchocerca volvulus		0.006	0.0366	0.3793
Mycobacterium ulcerans	aldehyde dehydrogenase	0.005	0.0291	0.7674
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.006	0.0366	1
Echinococcus granulosus	FTZ F1 alpha	0.0453	0.3316	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0023	0.0083	0.2437
Plasmodium falciparum	acyl-CoA synthetase	0.0045	0.0251	1
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0046	0.0546
Brugia malayi	jmjC domain containing protein	0.0013	0.001	0.0067
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Schistosoma mansoni	jumonji domain containing protein	0.0013	0.001	0.0071
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0014	0.0017	0.0292
Trypanosoma cruzi	cysteine peptidase, putative	0.0014	0.0017	0.0235
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0174	0.0524
Echinococcus multilocularis	JmjC domain containing protein 4	0.0013	0.001	0.001
Plasmodium vivax	vivapain-2	0.0014	0.0017	0.0292
Entamoeba histolytica	acyl-CoA synthetase, putative	0.006	0.0366	1
Echinococcus granulosus	acetyl coenzyme A synthetase cytoplasmic	0.0018	0.0046	0.0138
Schistosoma mansoni	hypothetical protein	0.004	0.0214	0.1482
Brugia malayi	jmjC domain containing protein	0.0013	0.001	0.0067
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0023	0.0083	0.1898
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0251	0.1658
Onchocerca volvulus		0.0018	0.0046	0.0475
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.006	0.0366	1
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Entamoeba histolytica	long-chain-fatty-acid--CoA ligase, putative	0.0018	0.0046	0.0821
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0023	0.0083	0.5
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0014	0.0017	0.0017
Leishmania major	4-coumarate:coa ligase-like protein	0.006	0.0366	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0014	0.0017	0.0292
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Onchocerca volvulus		0.0014	0.0017	0.0179
Toxoplasma gondii	aldehyde dehydrogenase	0.005	0.0291	1
Leishmania major	4-coumarate:coa ligase-like protein	0.006	0.0366	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0203	0.1441	0.9506
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0203	0.1441	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0203	0.1441	0.9506
Leishmania major	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1003
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0045	0.0251	0.5
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0023	0.0083	0.2437
Echinococcus granulosus	cathepsin l1	0.0014	0.0017	0.0052
Echinococcus multilocularis	acetyl coenzyme A synthetase, cytoplasmic	0.0018	0.0046	0.0046
Trichomonas vaginalis	antibiotic synthetase, putative	0.0018	0.0046	0.0191
Brugia malayi	jmjC domain containing protein	0.0013	0.001	0.0067
Brugia malayi	AMP-binding enzyme family protein	0.006	0.0366	0.2414
Trypanosoma cruzi	major cysteine proteinase, putative	0.0042	0.0225	0.7166
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0023	0.0083	0.5
Echinococcus multilocularis	phd:f box containing protein	0.0013	0.001	0.001
Leishmania major	cathepsin L-like protease	0.0053	0.0311	0.8446
Onchocerca volvulus		0.0014	0.0017	0.0179
Trichomonas vaginalis	glucosylceramidase, putative	0.0213	0.1516	1
Onchocerca volvulus		0.0014	0.0017	0.0179
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0023	0.0083	0.055
Schistosoma mansoni	phosphatidylserine receptor	0.0013	0.001	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0251	0.1658
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0018	0.0046	0.0302
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.006	0.0366	1
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0049	0.0278	0.1928
Leishmania major	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1003
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0023	0.0083	0.2437
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.005	0.0291	0.7907
Echinococcus granulosus	lysine specific demethylase 5A	0.0049	0.0278	0.0838
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Leishmania major	cathepsin L-like protease	0.0053	0.0311	0.8446
Toxoplasma gondii	Acetyl-coenzyme A synthetase 2, putative	0.0018	0.0046	0.1268
Trypanosoma cruzi	cysteine peptidase, putative	0.0053	0.0311	1
Brugia malayi	AMP-binding enzyme family protein	0.0018	0.0046	0.0302
Mycobacterium ulcerans	aldehyde dehydrogenase	0.005	0.0291	0.7674
Loa Loa (eye worm)	hypothetical protein	0.006	0.0366	0.2414
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1
Trichomonas vaginalis	glucosylceramidase, putative	0.014	0.0964	0.6322
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0048	0.0276	0.8851
Toxoplasma gondii	cathepsin CPL	0.0014	0.0017	0.0251
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0018	0.0046	0.0546
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.004	0.0214	0.1409
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0.0083	0.5
Brugia malayi	AMP-binding enzyme family protein	0.006	0.0366	0.2414
Plasmodium falciparum	ataxin-2 like protein, putative	0.0021	0.0069	0.2451
Leishmania major	cathepsin L-like protease	0.0053	0.0311	0.8446
Echinococcus granulosus	geminin	0.014	0.0964	0.2908
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0251	0.1658
Brugia malayi	jmjC domain containing protein	0.0049	0.0278	0.1833
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0052	0.0306	0.2019
Schistosoma mansoni	aldehyde dehydrogenase	0.005	0.0291	0.2022
Onchocerca volvulus	Cathepsin F homolog	0.0014	0.0017	0.0179
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0013	0.001	0.001
Brugia malayi	RNA recognition motif domain containing protein	0.0052	0.0306	0.2019
Brugia malayi	hypothetical protein	0.0013	0.0014	0.0091
Trichomonas vaginalis	antibiotic synthetase, putative	0.0018	0.0046	0.0191
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0203	0.1441	1
Schistosoma mansoni	hypothetical protein	0.014	0.0964	0.6694
Onchocerca volvulus		0.0014	0.0017	0.0179
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0017	0.0114
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0049	0.0278	0.0838
Brugia malayi	hypothetical protein	0.0021	0.0069	0.0457
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0018	0.0046	0.0546
Onchocerca volvulus		0.0014	0.0017	0.0179
Leishmania major	cathepsin L-like protease	0.0014	0.0017	0.0198
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.006	0.0366	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0043	0.0233	0.6071
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0023	0.0083	0.2059
Echinococcus granulosus	jumonji domain containing 1A	0.0013	0.001	0.0031
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0174	0.1207
Brugia malayi	TAR-binding protein	0.0052	0.0306	0.2019
Schistosoma mansoni	ap endonuclease	0.0023	0.0083	0.0579
Plasmodium falciparum	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1479
Echinococcus multilocularis	jumonji domain containing 1A	0.0013	0.001	0.001
Loa Loa (eye worm)	jmjC domain-containing protein	0.0013	0.001	0.0067
Schistosoma mansoni	cathepsin F (C01 family)	0.0014	0.0017	0.012
Trypanosoma brucei	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1187
Plasmodium vivax	acetyl-CoA synthetase, putative	0.0018	0.0046	0.1479
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0053	0.0311	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.0037 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)	8.4368 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	21.3313 uM	PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411]	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273]	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: CHEMBL1551306

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1424649