TDR Targets

Basic information

Technical information

TDR Targets ID: 1405620
Name: N-[4-(morpholin-4-ylmethyl)phenyl]-3-propoxyb enzamide
MW: 354.443 | Formula: C21H26N2O3
H donors: 1 H acceptors: 1 LogP: 3.08 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCCOc1cccc(c1)C(=O)Nc1ccc(cc1)CN1CCOCC1
InChi: 1S/C21H26N2O3/c1-2-12-26-20-5-3-4-18(15-20)21(24)22-19-8-6-17(7-9-19)16-23-10-13-25-14-11-23/h3-9,15H,2,10-14,16H2,1H3,(H,22,24)
InChiKey: FJGPTCNRXWTPNH-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

N-[4-(morpholinomethyl)phenyl]-3-propoxy-benzamide
N-[4-(morpholinomethyl)phenyl]-3-propoxybenzamide
N-[4-(morpholin-4-ylmethyl)phenyl]-3-propoxy-benzamide
Oprea1_422246
MLS001180795
SMR000477746
AP-970/41680529
N-[4-(4-morpholinylmethyl)phenyl]-3-propoxybenzamide
STK243843

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Escherichia coli	penicillin-binding protein	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
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	Possible penicillin-binding protein	Get druggable targets OG5_149948	All targets in OG5_149948
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088

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 %
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	cathepsin F-like cysteine proteinase	0.0236	0.0848	0.0836
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0009	0.0013	0.0001
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Brugia malayi	beta-lactamase	0.0043	0.0141	0.0129
Mycobacterium tuberculosis	Probable hydrolase	0.0043	0.0141	0.0927
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0938	0.3426	0.3418
Entamoeba histolytica	cysteine proteinase 1, putative	0.0521	0.1893	0.5455
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0019	0.0052	0.0039
Giardia lamblia	Cathepsin B precursor	0.1007	0.3679	1
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0185	0.0185
Entamoeba histolytica	cysteine proteinase, putative	0.0938	0.3426	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.002	0.0053	0.0041
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0236	0.0848	0.2356
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0236	0.0848	0.2356
Trypanosoma cruzi	cysteine peptidase, putative	0.0938	0.3426	0.3391
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.002	0.0053	0.0041
Onchocerca volvulus	Cathepsin L homolog	0.0938	0.3426	1
Brugia malayi	fibroinase precursor	0.0236	0.0848	0.0836
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0236	0.0848	0.0836
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Trypanosoma cruzi	cysteine protease, putative	0.0521	0.1893	0.185
Onchocerca volvulus		0.0938	0.3426	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0938	0.3426	0.3391
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0141	0.0927
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0938	0.3426	0.3418
Echinococcus multilocularis	geminin	0.0205	0.0733	0.0721
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0236	0.0848	0.2283
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0013	0.0013
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Entamoeba histolytica	cysteine proteinase, putative	0.0521	0.1893	0.5455
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0236	0.0848	0.0848
Schistosoma mansoni	cpg binding protein	0.0037	0.0116	0.0116
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.0141	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0285	0.1027	0.1015
Brugia malayi	Cathepsin L-like precursor	0.0285	0.1027	0.1015
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.002	0.0053	0.5
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0236	0.0848	0.2356
Brugia malayi	Papain family cysteine protease containing protein	0.0236	0.0848	0.0836
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.0053	0.0117
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0521	0.1893	0.5075
Echinococcus multilocularis	cysteine protease	0.0938	0.3426	0.3418
Echinococcus multilocularis	cathepsin L	0.0236	0.0848	0.0836
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0236	0.0848	0.2356
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0938	0.3426	0.3418
Schistosoma mansoni	smad	0.0008	0.0013	0.0013
Trypanosoma cruzi	cruzipain precursor, putative	0.0285	0.1027	0.0979
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0019	0.0052	0.0039
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0236	0.0848	0.2283
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Brugia malayi	Papain family cysteine protease containing protein	0.0521	0.1893	0.1883
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0109	0.0096
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0236	0.0848	0.0848
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0109	0.0096
Plasmodium vivax	vivapain-1	0.0521	0.1893	0.5455
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Plasmodium falciparum	serine repeat antigen 5	0.0236	0.0848	0.2356
Brugia malayi	cathepsin F-like cysteine proteinase	0.0285	0.1027	0.1015
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.0141	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0236	0.0848	0.2192
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.1007	0.3679	1
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0019	0.0052	0.0039
Entamoeba histolytica	hypothetical protein	0.0236	0.0848	0.2356
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Trypanosoma brucei	cysteine peptidase C (CPC)	0.1007	0.3679	1
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Schistosoma mansoni	hypothetical protein	0.0019	0.0052	0.0052
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0938	0.3426	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0236	0.0848	0.2283
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0021	0.0008
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0521	0.1893	0.1893
Onchocerca volvulus		0.0938	0.3426	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0236	0.0848	0.0848
Mycobacterium ulcerans	hypothetical protein	0.0043	0.0141	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Brugia malayi	cathepsin L-like precursor	0.0653	0.2381	0.2371
Toxoplasma gondii	cathepsin CPC1	0.0236	0.0848	0.2192
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0141	0.0129
Giardia lamblia	Encystation-specific protease	0.0236	0.0848	0.2192
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Plasmodium vivax	vivapain-2	0.0938	0.3426	1
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0141	0.0141
Entamoeba histolytica	cysteine proteinase, putative	0.0938	0.3426	1
Plasmodium vivax	unspecified product	0.0236	0.0848	0.2356
Leishmania major	hypothetical protein, conserved	0.0043	0.0141	0.0243
Loa Loa (eye worm)	hypothetical protein	0.0285	0.1027	0.1015
Echinococcus granulosus	cpg binding protein	0.0037	0.0116	0.0104
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Echinococcus granulosus	geminin	0.0205	0.0733	0.0721
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Schistosoma mansoni	hypothetical protein	0.0019	0.0052	0.0052
Plasmodium vivax	unspecified product	0.0521	0.1893	0.5455
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.0203	0.019
Loa Loa (eye worm)	hypothetical protein	0.0285	0.1027	0.1015
Brugia malayi	Cathepsin L-like precursor	0.0653	0.2381	0.2371
Brugia malayi	Papain family cysteine protease containing protein	0.0236	0.0848	0.0836
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0236	0.0848	0.2283
Plasmodium vivax	vivapain-2	0.0938	0.3426	1
Loa Loa (eye worm)	hypothetical protein	0.0653	0.2381	0.2371
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0236	0.0848	0.2283
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Loa Loa (eye worm)	hypothetical protein	0.0938	0.3426	0.3418
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0052	0.0039
Brugia malayi	cathepsin L-like cysteine proteinase	0.0236	0.0848	0.0836
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0185	0.0172
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0236	0.0848	0.2356
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Loa Loa (eye worm)	cysteine protease	0.0938	0.3426	0.3418
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0236	0.0848	0.2356
Brugia malayi	beta-lactamase family protein	0.0043	0.0141	0.0129
Plasmodium vivax	serine-repeat antigen (SERA)	0.0236	0.0848	0.2356
Toxoplasma gondii	cathepsin B	0.1007	0.3679	1
Trichomonas vaginalis	conserved hypothetical protein	0.0236	0.0848	0.2283
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0653	0.2381	0.6462
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0141	0.0927
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0236	0.0848	0.0848
Schistosoma mansoni	cpg binding protein	0.0035	0.0109	0.0109
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0013	0.0001
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Schistosoma mansoni	cathepsin C	0.0236	0.0848	0.0848
Schistosoma mansoni	hypothetical protein	0.0205	0.0733	0.0733
Giardia lamblia	Cathepsin L-like protease	0.0236	0.0848	0.2192
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0185	0.0172
Entamoeba histolytica	cysteine proteinase, putative	0.0653	0.2381	0.6901
Entamoeba histolytica	cysteine proteinase, putative	0.0521	0.1893	0.5455
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0236	0.0848	0.0848
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0141	0.0088
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0236	0.0848	0.2356
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0236	0.0848	0.0848
Schistosoma mansoni	hypothetical protein	0.0205	0.0733	0.0733
Schistosoma mansoni	hypothetical protein	0.0019	0.0052	0.0052
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0013	0.0013
Echinococcus multilocularis	cathepsin L cysteine protease	0.0938	0.3426	0.3418
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0236	0.0848	0.2283
Brugia malayi	Cathepsin L-like precursor	0.0653	0.2381	0.2371
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Trypanosoma cruzi	cysteine peptidase, putative	0.0938	0.3426	0.3391
Echinococcus granulosus	cathepsin L cysteine protease	0.0521	0.1893	0.1883
Toxoplasma gondii	cathepsin CPC2	0.0236	0.0848	0.2192
Echinococcus multilocularis	dnaJ subfamily B	0.0494	0.1796	0.1785
Trypanosoma cruzi	cysteine proteinase, putative	0.0521	0.1893	0.185
Plasmodium falciparum	serine repeat antigen 4	0.0236	0.0848	0.2356
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Loa Loa (eye worm)	hypothetical protein	0.0653	0.2381	0.2371
Echinococcus multilocularis	cysteine protease	0.0938	0.3426	0.3418
Onchocerca volvulus		0.0043	0.0141	0.0097
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0236	0.0848	0.2283
Leishmania major	cysteine peptidase A (CPA)	0.0938	0.3426	0.9303
Giardia lamblia	Cathepsin B precursor	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.1007	0.3679	1
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0938	0.3426	0.3418
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.0141	0.0129
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0185	0.0185
Echinococcus multilocularis	GPCR, family 2	0.0019	0.0052	0.0039
Onchocerca volvulus	Cathepsin L homolog	0.0236	0.0848	0.2228
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0236	0.0848	0.2192
Echinococcus granulosus	dnaJ subfamily B	0.0494	0.1796	0.1785
Brugia malayi	Papain family cysteine protease containing protein	0.0938	0.3426	0.3418
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0938	0.3426	0.3418
Plasmodium vivax	vivapain-3	0.0521	0.1893	0.5455
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0236	0.0848	0.2283
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Echinococcus granulosus	GPCR family 2	0.0019	0.0052	0.0039
Trypanosoma cruzi	cysteine peptidase, putative	0.0285	0.1027	0.0979
Echinococcus multilocularis	cpg binding protein	0.0037	0.0116	0.0104
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Giardia lamblia	Cysteine protease	0.0236	0.0848	0.2192
Giardia lamblia	Cathepsin B precursor	0.1007	0.3679	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0521	0.1893	0.1893
Schistosoma mansoni	cathepsin s	0.0285	0.1027	0.1027
Mycobacterium tuberculosis	Probable lipase LipE	0.0043	0.0141	0.0927
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0021	0.0008
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0938	0.3426	0.3418
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0285	0.1027	0.1015
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0236	0.0848	0.2283
Giardia lamblia	Cathepsin B precursor	0.0236	0.0848	0.2192
Schistosoma mansoni	hypothetical protein	0.0019	0.0052	0.0052
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.0223	0.0468
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Entamoeba histolytica	cysteine proteinase, putative	0.0521	0.1893	0.5455
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0236	0.0848	0.2192
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Onchocerca volvulus	Cathepsin L homolog	0.0938	0.3426	1
Onchocerca volvulus		0.0938	0.3426	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Plasmodium falciparum	serine repeat antigen 2	0.0236	0.0848	0.2356
Onchocerca volvulus	Cathepsin F homolog	0.0938	0.3426	1
Onchocerca volvulus		0.0043	0.0141	0.0097
Mycobacterium leprae	Probable lipase LipE	0.0043	0.0141	0.5
Plasmodium falciparum	serine repeat antigen 9	0.0236	0.0848	0.2356
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0938	0.3426	0.9312
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0521	0.1893	0.1893
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Plasmodium vivax	serine-repeat antigen (SERA)	0.0236	0.0848	0.2356
Giardia lamblia	Cysteine protease	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0653	0.2381	0.6462
Schistosoma mansoni	cathepsin S (C01 family)	0.0236	0.0848	0.0848
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0521	0.1893	0.5455
Giardia lamblia	Hypothetical protein	0.0236	0.0848	0.2192
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0185	0.0172
Echinococcus granulosus	cathepsin L	0.0236	0.0848	0.0836
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0185	0.0172
Mycobacterium leprae	conserved hypothetical protein	0.0043	0.0141	0.5
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1007	0.3679	0.3645
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0938	0.3426	1
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0043	0.0141	0.0927
Echinococcus multilocularis	cathepsin L	0.0521	0.1893	0.1883
Trypanosoma cruzi	cysteine peptidase, putative	0.0521	0.1893	0.185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Giardia lamblia	Cathepsin B precursor	0.1007	0.3679	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0236	0.0848	0.0848
Schistosoma mansoni	Smad4	0.0008	0.0013	0.0013
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0236	0.0848	0.0848
Schistosoma mansoni	ap endonuclease	0.002	0.0053	0.0053
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trypanosoma cruzi	cysteine peptidase, putative	0.0938	0.3426	0.3391
Loa Loa (eye worm)	beta-lactamase	0.0043	0.0141	0.0129
Schistosoma mansoni	hypothetical protein	0.0041	0.0133	0.0133
Giardia lamblia	Cathepsin B precursor	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0938	0.3426	0.9312
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0278	0.1002	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Echinococcus granulosus	cysteine protease	0.0521	0.1893	0.1883
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0938	0.3426	1
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Plasmodium falciparum	serine repeat antigen 1	0.0236	0.0848	0.2356
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.0141	0.0129
Onchocerca volvulus		0.0938	0.3426	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0653	0.2381	0.2371
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0236	0.0848	0.2356
Entamoeba histolytica	cysteine proteinase 2	0.0521	0.1893	0.5455
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0043	0.0141	0.0927
Entamoeba histolytica	cysteine proteinase, putative	0.0521	0.1893	0.5455
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.0053	0.0117
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0236	0.0848	0.2283
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0203	0.019
Onchocerca volvulus		0.0938	0.3426	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0141	0.0357
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0236	0.0848	0.2356
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0133	0.012
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Schistosoma mansoni	ap endonuclease	0.002	0.0053	0.0053
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0013	0.0013
Giardia lamblia	Cathepsin B precursor	0.0236	0.0848	0.2192
Echinococcus granulosus	cathepsin L	0.0521	0.1893	0.1883
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Giardia lamblia	Cysteine protease	0.0236	0.0848	0.2192
Echinococcus multilocularis	cathepsin L cysteine protease	0.0938	0.3426	0.3418
Loa Loa (eye worm)	cathepsin B	0.1007	0.3679	0.3671
Giardia lamblia	Cathepsin L precursor	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0133	0.012
Schistosoma mansoni	cpg binding protein	0.0037	0.0116	0.0116
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0019	0.0052	0.0039
Brugia malayi	MH2 domain containing protein	0.0124	0.0437	0.0425
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0013	0.0013
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.0252	0.0252
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0141	0.0129
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Echinococcus granulosus	cathepsin l1	0.0938	0.3426	0.3418
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Plasmodium falciparum	serine repeat antigen 3	0.0236	0.0848	0.2356
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Echinococcus granulosus	cathepsin l1	0.0653	0.2381	0.2371
Giardia lamblia	Cysteine protease	0.0236	0.0848	0.2192
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0185	0.0172
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0236	0.0848	0.2192
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0141	0.0243
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0013	0.0001
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0236	0.0848	0.0836
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0521	0.1893	0.185
Plasmodium falciparum	serine repeat antigen 7	0.0236	0.0848	0.2356
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0021	0.0008
Entamoeba histolytica	cysteine protease, putative	0.0236	0.0848	0.2356
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0141	0.0357
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0019	0.0052	0.0039
Loa Loa (eye worm)	ctsf protein	0.0938	0.3426	0.3418
Treponema pallidum	exodeoxyribonuclease (exoA)	0.002	0.0053	0.5
Onchocerca volvulus		0.0043	0.0141	0.0097
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0236	0.0848	0.0836
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trypanosoma cruzi	major cysteine proteinase, putative	0.0236	0.0848	0.0799
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.002	0.0053	0.0041
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Giardia lamblia	Hypothetical protein	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0521	0.1893	0.5133
Loa Loa (eye worm)	hypothetical protein	0.0653	0.2381	0.2371
Mycobacterium tuberculosis	Probable lipase LipD	0.0043	0.0141	0.0927
Brugia malayi	exodeoxyribonuclease III family protein	0.002	0.0053	0.0041
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0236	0.0848	0.0836
Brugia malayi	beta-lactamase family protein	0.0043	0.0141	0.0129
Loa Loa (eye worm)	transcription factor SMAD2	0.0124	0.0437	0.0425
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0141	0.0357
Mycobacterium ulcerans	lipase LipD	0.0043	0.0141	1
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0236	0.0848	0.2356
Trypanosoma cruzi	cruzipain precursor, putative	0.0938	0.3426	0.3391
Plasmodium falciparum	serine repeat antigen 6	0.0236	0.0848	0.2356
Mycobacterium ulcerans	beta-lactamase	0.0043	0.0141	1
Onchocerca volvulus		0.0938	0.3426	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0185	0.0185
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0938	0.3426	0.9303
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0141	0.0357
Trichomonas vaginalis	esterase, putative	0.0043	0.0141	0.0357
Giardia lamblia	Cathepsin L-like protease	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0185	0.0172
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0013	0.0013
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0043	0.0141	0.0927
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0019	0.0052	0.0039
Onchocerca volvulus		0.0653	0.2381	0.6849
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0236	0.0848	0.2283
Toxoplasma gondii	cathepsin CPL	0.0938	0.3426	0.9303
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Schistosoma mansoni	cathepsin B (C01 family)	0.0236	0.0848	0.0848
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Giardia lamblia	Cathepsin B precursor	0.0236	0.0848	0.2192
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0236	0.0848	0.0836
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0521	0.1893	0.5075
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Loa Loa (eye worm)	hypothetical protein	0.0236	0.0848	0.0836
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0141	0.0088
Onchocerca volvulus		0.0236	0.0848	0.2228
Loa Loa (eye worm)	hypothetical protein	0.0285	0.1027	0.1015
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0236	0.0848	0.2356
Brugia malayi	Papain family cysteine protease containing protein	0.0236	0.0848	0.0836
Brugia malayi	cathepsin L precursor	0.0236	0.0848	0.0836
Mycobacterium tuberculosis	Probable esterase LipL	0.0043	0.0141	0.0927
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0009	0.0013	0.0001
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0141	0.0141
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0236	0.0848	0.2356
Onchocerca volvulus		0.0938	0.3426	1
Loa Loa (eye worm)	fibroinase	0.0938	0.3426	0.3418
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0236	0.0848	0.2192
Brugia malayi	Papain family cysteine protease containing protein	0.0521	0.1893	0.1883
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0141	0.0261
Loa Loa (eye worm)	hypothetical protein	0.006	0.0203	0.019
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0141	0.0927
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0236	0.0848	0.2356
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0653	0.2381	0.234
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0141	0.0357
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0236	0.0848	0.2283
Entamoeba histolytica	cysteine protease, putative	0.0938	0.3426	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0124	0.0437	0.0425
Trypanosoma cruzi	major cysteine proteinase, putative	0.0236	0.0848	0.0799
Trypanosoma cruzi	cysteine proteinase, putative	0.0521	0.1893	0.185
Leishmania major	cathepsin L-like protease	0.0938	0.3426	0.9303
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0141	0.0129
Schistosoma mansoni	cathepsin F (C01 family)	0.0653	0.2381	0.2381
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0236	0.0848	0.0848
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0236	0.0848	0.2356
Plasmodium vivax	unspecified product	0.0285	0.1027	0.2886
Brugia malayi	Cathepsin L-like precursor	0.0938	0.3426	0.3418
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0021	0.0008
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Entamoeba histolytica	cysteine protease, putative	0.0521	0.1893	0.5455
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0521	0.1893	0.5133
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0236	0.0848	0.2356
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0938	0.3426	0.9312
Toxoplasma gondii	ABC1 family protein	0.0043	0.0141	0.0243
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.0203	0.019
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0236	0.0848	0.0836
Brugia malayi	Latrophilin receptor protein 2	0.0019	0.0052	0.0039
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0938	0.3426	0.9312
Trichomonas vaginalis	conserved hypothetical protein	0.0236	0.0848	0.2283
Schistosoma mansoni	hypothetical protein	0.0494	0.1796	0.1796
Schistosoma mansoni	cathepsin F (C01 family)	0.0938	0.3426	0.3426
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1007	0.3679	0.3679
Schistosoma mansoni	cathepsin F (C01 family)	0.0938	0.3426	0.3426
Plasmodium falciparum	serine repeat antigen 8	0.0236	0.0848	0.2356

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	1 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 1.5849 um	PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))]	ChEMBL.	No reference
Potency (functional)	11.6891 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)	12.5893 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	20.5962 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	26.8545 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)	28.1838 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	44.6684 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1564661

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1405620