TDR Targets

Basic information

Technical information

TDR Targets ID: 1383949
Name: 2-(cyclohexyl-methylamino)-N-(3,4-dichlorophe nyl)acetamide; oxalic acid
MW: 405.273 | Formula: C17H22Cl2N2O5
H donors: 3 H acceptors: 5 LogP: 1.7 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)C(=O)O.O=C(Nc1ccc(c(c1)Cl)Cl)CN(C1CCCCC1)C
InChi: 1S/C15H20Cl2N2O.C2H2O4/c1-19(12-5-3-2-4-6-12)10-15(20)18-11-7-8-13(16)14(17)9-11;3-1(4)2(5)6/h7-9,12H,2-6,10H2,1H3,(H,18,20);(H,3,4)(H,5,6)
InChiKey: BOKAQDFNSAMZAJ-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-(cyclohexyl-methyl-amino)-N-(3,4-dichlorophenyl)acetamide; oxalic acid
2-(cyclohexyl-methyl-amino)-N-(3,4-dichlorophenyl)ethanamide; ethanedioic acid
2-(Cyclohexyl-methyl-amino)-N-(3,4-dichloro-phenyl)-acetamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Giardia intestinalis	Putative fructose-1,6-bisphosphate aldolase	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	SMAD family member 2	Starlite/ChEMBL	No references
Homo sapiens	chromobox homolog 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	chromobox protein, putative	Get druggable targets OG5_129545	All targets in OG5_129545
Onchocerca volvulus	Heterochromatin protein 1 homolog	Get druggable targets OG5_129545	All targets in OG5_129545
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Brugia malayi	MH2 domain containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Loa Loa (eye worm)	MH2 domain-containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Brugia malayi	Heterochromatin protein 1	Get druggable targets OG5_129545	All targets in OG5_129545
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	chromobox protein, putative	Get druggable targets OG5_129545	All targets in OG5_129545
Trichomonas vaginalis	chromobox protein, putative	Get druggable targets OG5_129545	All targets in OG5_129545
Echinococcus granulosus	chromobox protein 1	Get druggable targets OG5_129545	All targets in OG5_129545
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Echinococcus granulosus	chromobox protein 1	Get druggable targets OG5_129545	All targets in OG5_129545
Echinococcus multilocularis	chromobox protein 1	Get druggable targets OG5_129545	All targets in OG5_129545
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129545	All targets in OG5_129545
Trichomonas vaginalis	chromobox protein, putative	Get druggable targets OG5_129545	All targets in OG5_129545
Treponema pallidum	fructose-bisphosphate aldolase	Get druggable targets OG5_129214	All targets in OG5_129214
Loa Loa (eye worm)	transcription factor SMAD2	Get druggable targets OG5_131716	All targets in OG5_131716
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Loa Loa (eye worm)	heterochromatin protein 1	Get druggable targets OG5_129545	All targets in OG5_129545
Schistosoma mansoni	chromobox protein	Get druggable targets OG5_129545	All targets in OG5_129545
Schistosoma mansoni	chromobox protein	Get druggable targets OG5_129545	All targets in OG5_129545
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Schistosoma japonicum	Chromobox protein homolog 5, putative	Get druggable targets OG5_129545	All targets in OG5_129545
Theileria parva	hypothetical protein	Get druggable targets OG5_129545	All targets in OG5_129545
Onchocerca volvulus		Get druggable targets OG5_129545	All targets in OG5_129545
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Giardia lamblia	Fructose-bisphosphate aldolase	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Echinococcus multilocularis	chromobox protein 1	Get druggable targets OG5_129545	All targets in OG5_129545

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Mycobacterium ulcerans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	26.9 %
Brugia malayi	MH2 domain containing protein	SMAD family member 2	467 aa	405 aa	31.6 %
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	25.5 %
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	25.8 %
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %
Candida albicans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	358 aa	22.6 %
Candida albicans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	358 aa	22.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Entamoeba histolytica	hypothetical protein	0.004	0.0681	0.0675
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Echinococcus granulosus	cathepsin b	0.0296	0.8316	1
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0062	0.1352	0.162
Loa Loa (eye worm)	cysteine protease	0.0055	0.1151	0.1384
Echinococcus granulosus	cathepsin L cysteine protease	0.0033	0.0477	0.0574
Echinococcus granulosus	multidrug resistance protein 1	0.0017	0.0005	0.0007
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0172	0.4631	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Echinococcus granulosus	cathepsin L	0.0033	0.0477	0.0574
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0033	0.0477	0.0567
Entamoeba histolytica	hypothetical protein	0.004	0.0681	0.0675
Brugia malayi	chromobox protein homolog 3	0.0047	0.0906	0.1084
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0055	0.1151	0.1384
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0055	0.1151	0.1146
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0033	0.0477	0.0567
Plasmodium falciparum	serine repeat antigen 4	0.0017	0.0017	0.0102
Brugia malayi	cathepsin F-like cysteine proteinase	0.0017	0.0017	0.0014
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Schistosoma mansoni	hypothetical protein	0.0019	0.007	0.0078
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0017	0.0017	0.0021
Toxoplasma gondii	cathepsin CPL	0.0055	0.1151	0.4444
Plasmodium vivax	vivapain-2	0.0055	0.1151	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0055	0.1151	0.1367
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Entamoeba histolytica	cysteine proteinase, putative	0.0033	0.0477	0.0472
Plasmodium falciparum	serine repeat antigen 2	0.0017	0.0017	0.0102
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0033	0.0477	0.0554
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0497	0.0492
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0017	0.0005	0.0007
Toxoplasma gondii	cathepsin CPC2	0.0017	0.0017	0.0045
Brugia malayi	Papain family cysteine protease containing protein	0.0055	0.1151	0.1379
Trichomonas vaginalis	chromobox protein, putative	0.0051	0.1013	0.1008
Onchocerca volvulus	Cathepsin L homolog	0.0055	0.1151	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0017	0.0017	0.0012
Giardia lamblia	Cathepsin B precursor	0.0104	0.2584	0.2571
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0296	0.8316	1
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0062	0.1352	0.1626
Loa Loa (eye worm)	calcium channel	0.0062	0.1352	0.1626
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Brugia malayi	Papain family cysteine protease containing protein	0.0017	0.0017	0.0014
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0104	0.2584	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.0681	0.0818
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0017	0.0005	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0005	0.0007
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Loa Loa (eye worm)	hypothetical protein	0.004	0.0691	0.0832
Echinococcus granulosus	cysteine protease	0.0033	0.0477	0.0574
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0017	0.0017	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Brugia malayi	MH2 domain containing protein	0.0144	0.3791	0.4556
Entamoeba histolytica	hypothetical protein	0.004	0.0681	0.0675
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0017	0.0005	0.0007
Trypanosoma cruzi	cysteine proteinase, putative	0.0033	0.0477	0.0554
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0062	0.1352	0.1626
Schistosoma mansoni	hypothetical protein	0.0019	0.007	0.0078
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0017	0.0017	0.0102
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0017	0.0017	0.0012
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0055	0.1151	0.1384
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Echinococcus multilocularis	cathepsin L cysteine protease	0.0055	0.1151	0.1384
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Plasmodium falciparum	serine repeat antigen 8	0.0017	0.0017	0.0102
Toxoplasma gondii	cathepsin CPC1	0.0017	0.0017	0.0045
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0033	0.0477	0.4115
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0017	0.0017	0.0102
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Onchocerca volvulus	Cathepsin L homolog	0.0055	0.1151	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0017	0.0005	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0062	0.1352	0.1626
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0497	0.0492
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.1294	0.1551
Brugia malayi	Heterochromatin protein 1	0.0084	0.2006	0.2407
Entamoeba histolytica	cysteine protease, putative	0.0055	0.1151	0.1146
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0062	0.1352	0.1626
Brugia malayi	Cathepsin L-like precursor	0.004	0.0691	0.0826
Echinococcus multilocularis	GPCR, family 2	0.0019	0.007	0.0085
Toxoplasma gondii	cathepsin B	0.0104	0.2584	1
Loa Loa (eye worm)	cathepsin B	0.0104	0.2584	0.3107
Onchocerca volvulus		0.0055	0.1151	1
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.0038	0.0628	0.0736
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0062	0.1352	0.1626
Brugia malayi	cathepsin L precursor	0.0017	0.0017	0.0014
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Schistosoma mansoni	hypothetical protein	0.0019	0.007	0.0078
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0033	0.0477	0.0472
Brugia malayi	cathepsin L-like precursor	0.004	0.0691	0.0826
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0296	0.8316	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0055	0.1151	0.1384
Entamoeba histolytica	cysteine proteinase 1, putative	0.0033	0.0477	0.0472
Entamoeba histolytica	cysteine proteinase, putative	0.0055	0.1151	0.1146
Echinococcus granulosus	chromobox protein 1	0.0084	0.2006	0.2412
Trypanosoma cruzi	cysteine peptidase, putative	0.0055	0.1151	0.1367
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0172	0.4631	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Brugia malayi	Papain family cysteine protease containing protein	0.0017	0.0017	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0055	0.1151	0.1384
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0017	0.0005	0.0007
Plasmodium vivax	vivapain-3	0.0033	0.0477	0.4115
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0062	0.1352	0.162
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0017	0.0017	0.0014
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0017	0.0017	0.0014
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0055	0.1151	0.1384
Treponema pallidum	fructose-bisphosphate aldolase	0.0353	1	0.5
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0017	0.0017	0.0102
Plasmodium falciparum	serine repeat antigen 9	0.0017	0.0017	0.0102
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0017	0.0005	0.0007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Entamoeba histolytica	cysteine proteinase, putative	0.0033	0.0477	0.0472
Echinococcus multilocularis	cathepsin b	0.0296	0.8316	1
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0062	0.1352	0.1626
Trypanosoma cruzi	cysteine peptidase, putative	0.0055	0.1151	0.1367
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0026	0.0288	0.0346
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Echinococcus granulosus	voltage dependent calcium channel	0.0062	0.1352	0.1626
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0728	0.0869
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Onchocerca volvulus		0.0055	0.1151	1
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0017	0.0017	0.0102
Entamoeba histolytica	hypothetical protein	0.0017	0.0017	0.0012
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0005	0.0007
Schistosoma mansoni	voltage-gated cation channel	0.0062	0.1352	0.162
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Brugia malayi	fibroinase precursor	0.0017	0.0017	0.0014
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0017	0.0005	0.0007
Trichomonas vaginalis	conserved hypothetical protein	0.0047	0.0906	0.0901
Entamoeba histolytica	cysteine proteinase 2	0.0033	0.0477	0.0472
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.004	0.0691	0.0686
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0017	0.0017	0.0021
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Entamoeba histolytica	hypothetical protein	0.004	0.0681	0.0675
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Loa Loa (eye worm)	hypothetical protein	0.0019	0.007	0.0085
Trypanosoma cruzi	cruzipain precursor, putative	0.0055	0.1151	0.1367
Plasmodium falciparum	serine repeat antigen 7	0.0017	0.0017	0.0102
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0062	0.1352	0.1626
Plasmodium vivax	vivapain-2	0.0055	0.1151	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0055	0.1151	0.1367
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0296	0.8316	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0033	0.0477	0.0567
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0104	0.2584	0.258
Plasmodium falciparum	serine repeat antigen 6	0.0017	0.0017	0.0102
Giardia lamblia	Cathepsin B precursor	0.0104	0.2584	0.2571
Onchocerca volvulus	Cathepsin L homolog	0.0017	0.0017	0.0102
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Echinococcus granulosus	chromobox protein 1	0.0084	0.2006	0.2412
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0062	0.1352	0.1626
Onchocerca volvulus		0.0055	0.1151	1
Trichomonas vaginalis	conserved hypothetical protein	0.0017	0.0017	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0906	0.109
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0017	0.0017	0.0102
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0055	0.1151	0.1384
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Brugia malayi	Papain family cysteine protease containing protein	0.0033	0.0477	0.0567
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0019	0.007	0.0085
Trichomonas vaginalis	chromobox protein, putative	0.0084	0.2006	0.2002
Schistosoma mansoni	hypothetical protein	0.0041	0.0728	0.0869
Loa Loa (eye worm)	hypothetical protein	0.0296	0.8316	1
Loa Loa (eye worm)	fibroinase	0.0055	0.1151	0.1384
Trichomonas vaginalis	chromobox protein, putative	0.0051	0.1013	0.1008
Plasmodium falciparum	serine repeat antigen 1	0.0017	0.0017	0.0102
Trypanosoma cruzi	cysteine proteinase, putative	0.0033	0.0477	0.0554
Echinococcus granulosus	cathepsin l1	0.0055	0.1151	0.1384
Echinococcus multilocularis	cathepsin b	0.0296	0.8316	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0055	0.1151	0.1146
Plasmodium vivax	unspecified product	0.0017	0.0017	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0728	0.0875
Trypanosoma cruzi	cysteine protease, putative	0.0033	0.0477	0.0554
Entamoeba histolytica	cysteine proteinase, putative	0.0033	0.0477	0.0472
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.1294	0.1551
Entamoeba histolytica	cysteine proteinase, putative	0.0033	0.0477	0.0472
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0017	0.0017	0.0102
Echinococcus multilocularis	multidrug resistance protein 1	0.0017	0.0005	0.0007
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0055	0.1151	0.1146
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0017	0.0017	0.0014
Echinococcus multilocularis	cathepsin L	0.0033	0.0477	0.0574
Onchocerca volvulus		0.0055	0.1151	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0017	0.0017	0.0014
Schistosoma mansoni	chromobox protein	0.0084	0.2006	0.2407
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0017	0.0017	0.0014
Echinococcus multilocularis	multidrug resistance protein 1	0.0017	0.0005	0.0007
Schistosoma mansoni	cathepsin F (C01 family)	0.0055	0.1151	0.1379
Echinococcus multilocularis	voltage dependent calcium channel	0.0062	0.1352	0.1626
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.004	0.0691	0.0686
Brugia malayi	hypothetical protein	0.004	0.0681	0.0812
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Schistosoma mansoni	cathepsin F (C01 family)	0.0055	0.1151	0.1379
Echinococcus granulosus	multidrug resistance protein 1	0.0017	0.0005	0.0007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Schistosoma mansoni	cathepsin C	0.0017	0.0017	0.0014
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Echinococcus granulosus	GPCR family 2	0.0019	0.007	0.0085
Echinococcus multilocularis	cathepsin L cysteine protease	0.0055	0.1151	0.1384
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0017	0.0005	0.0007
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0051	0.1013	0.8792
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0055	0.1151	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Plasmodium vivax	serine-repeat antigen (SERA)	0.0017	0.0017	0.0102
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0017	0.0017	0.0014
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0104	0.2584	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0017	0.0017	0.0021
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0296	0.8316	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Brugia malayi	Papain family cysteine protease containing protein	0.0017	0.0017	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.0681	0.0812
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Brugia malayi	Papain family cysteine protease containing protein	0.0033	0.0477	0.0567
Schistosoma mansoni	hypothetical protein	0.0186	0.5046	0.6066
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Giardia lamblia	Fructose-bisphosphate aldolase	0.0353	1	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0019	0.007	0.0085
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0353	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0017	0.0017	0.0014
Echinococcus multilocularis	cysteine protease	0.0055	0.1151	0.1384
Loa Loa (eye worm)	hypothetical protein	0.004	0.0691	0.0832
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0017	0.0017	0.0102
Echinococcus multilocularis	cathepsin L	0.0017	0.0017	0.0021
Echinococcus multilocularis	geminin	0.0186	0.5046	0.6068
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Echinococcus multilocularis	chromobox protein 1	0.0084	0.2006	0.2412
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0104	0.2584	0.3093
Schistosoma mansoni	cathepsin S (C01 family)	0.0017	0.0017	0.0014
Echinococcus granulosus	cathepsin b	0.0296	0.8316	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Trichomonas vaginalis	chromobox protein, putative	0.0084	0.2006	0.2002
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0296	0.8316	1
Schistosoma mansoni	cathepsin F (C01 family)	0.004	0.0691	0.0826
Echinococcus granulosus	multidrug resistance protein 1	0.0017	0.0005	0.0007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Plasmodium vivax	unspecified product	0.0033	0.0477	0.4115
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0017	0.0017	0.0102
Schistosoma mansoni	hypothetical protein	0.0019	0.007	0.0078
Echinococcus granulosus	cathepsin l1	0.004	0.0691	0.0832
Loa Loa (eye worm)	hypothetical protein	0.004	0.0691	0.0832
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Loa Loa (eye worm)	multidrug resistance protein 3	0.0017	0.0005	0.0007
Loa Loa (eye worm)	ctsf protein	0.0055	0.1151	0.1384
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0017	0.0017	0.0014
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.1294	0.1556
Loa Loa (eye worm)	MH2 domain-containing protein	0.0144	0.3791	0.4559
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0062	0.1352	0.162
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Trichomonas vaginalis	conserved hypothetical protein	0.0047	0.0906	0.0901
Plasmodium vivax	serine-repeat antigen (SERA)	0.0017	0.0017	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Onchocerca volvulus		0.0037	0.0603	0.5218
Trichomonas vaginalis	conserved hypothetical protein	0.0017	0.0017	0.0012
Echinococcus multilocularis	cysteine protease	0.0055	0.1151	0.1384
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0172	0.4631	0.5
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Loa Loa (eye worm)	transcription factor SMAD2	0.0144	0.3791	0.4559
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0017	0.0017	0.0102
Trypanosoma cruzi	cysteine peptidase, putative	0.0033	0.0477	0.0554
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0017	0.0005	0.5
Leishmania major	cysteine peptidase A (CPA)	0.0055	0.1151	0.4444
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0603	0.0726
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0055	0.1151	0.1384
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0017	0.0017	0.0102
Schistosoma mansoni	hypothetical protein	0.004	0.0681	0.0812
Loa Loa (eye worm)	hypothetical protein	0.006	0.1294	0.1556
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Echinococcus multilocularis	chromobox protein 1	0.0084	0.2006	0.2412
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0017	0.0017	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Onchocerca volvulus		0.0017	0.0017	0.0102
Loa Loa (eye worm)	heterochromatin protein 1	0.0084	0.2006	0.2412
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0019	0.007	0.0085
Entamoeba histolytica	cysteine proteinase, putative	0.004	0.0691	0.0686
Plasmodium falciparum	serine repeat antigen 3	0.0017	0.0017	0.0102
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.0681	0.0818
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0019	0.007	0.0085
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0017	0.0012
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0017	0.0005	0.0007
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.0038	0.0628	0.0717
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0017	0.0017	0.0014
Brugia malayi	Latrophilin receptor protein 2	0.0019	0.007	0.0078
Schistosoma mansoni	cathepsin B (C01 family)	0.0017	0.0017	0.0014
Giardia lamblia	Cathepsin B precursor	0.0104	0.2584	0.2571
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0019	0.007	0.0085
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0017	0.0017	0.0102
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0017	0.0017	0.0012
Echinococcus granulosus	cathepsin L	0.0017	0.0017	0.0021
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0055	0.1151	0.1146
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0017	0.0017	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0017	0.0021
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Echinococcus multilocularis	sodium channel protein	0.0026	0.0288	0.0346
Schistosoma mansoni	hypothetical protein	0.0186	0.5046	0.6066
Onchocerca volvulus	Cathepsin F homolog	0.0055	0.1151	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0017	0.0017	0.0014
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	1	1
Schistosoma mansoni	chromobox protein	0.0084	0.2006	0.2407
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0104	0.2584	0.3102
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0017	0.0017	0.0012
Echinococcus granulosus	geminin	0.0186	0.5046	0.6068
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0017	0.0017	0.0014
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0033	0.0477	0.0472
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0017	0.0017	0.0102
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0019	0.007	0.0078
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0055	0.1151	1
Brugia malayi	Cathepsin L-like precursor	0.0055	0.1151	0.1379
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0017	0.0017	0.0012
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0017	0.0017	0.0012
Onchocerca volvulus		0.0055	0.1151	1
Echinococcus multilocularis	voltage dependent calcium channel	0.0062	0.1352	0.1626
Plasmodium vivax	vivapain-1	0.0033	0.0477	0.4115
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0017	0.0017	0.0014
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0047	0.0906	0.7863
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0055	0.1151	1
Plasmodium falciparum	serine repeat antigen 5	0.0017	0.0017	0.0102
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0055	0.1151	0.1146
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.004	0.0691	0.0813
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0017	0.0005	0.0007
Brugia malayi	Cathepsin L-like cysteine proteinase	0.004	0.0691	0.0826
Onchocerca volvulus		0.004	0.0691	0.5987
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0017	0.0017	0.0014
Brugia malayi	Cathepsin L-like precursor	0.004	0.0691	0.0826
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0017	0.0017	0.0012
Brugia malayi	cathepsin B-like cysteine proteinase	0.0296	0.8316	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0055	0.1151	0.3201
Leishmania major	cathepsin L-like protease	0.0055	0.1151	0.4444
Entamoeba histolytica	cysteine protease, putative	0.0033	0.0477	0.0472
Onchocerca volvulus		0.0055	0.1151	1
Onchocerca volvulus		0.0055	0.1151	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	7.9433 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	10 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	11.6891 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 14.1254 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)	14.1254 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 (binding)	= 22.3872 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)	22.3872 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference
Potency (functional)	22.3872 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)	35.4813 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	50.1187 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

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: CHEMBL1530842

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1383949