TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 398.883 | Formula: C22H23ClN2O3
H donors: 2 H acceptors: 2 LogP: 4.89 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCO/C(=C(\C1=NC(C)(C)Cc2c1cccc2)/C(=O)Nc1ccccc1Cl)/O
InChi: 1S/C22H23ClN2O3/c1-4-28-21(27)18(20(26)24-17-12-8-7-11-16(17)23)19-15-10-6-5-9-14(15)13-22(2,3)25-19/h5-12,27H,4,13H2,1-3H3,(H,24,26)/b21-18+
InChiKey: PDGSHVHJZOTLHO-DYTRJAOYSA-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	aldehyde dehydrogenase 1 family, member A1	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	tumor protein p53	Starlite/ChEMBL	No references
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	tumor protein p63	Get druggable targets OG5_140038	All targets in OG5_140038
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania braziliensis	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Aldehyde dehydrogenase X, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) 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	tumor protein p63	Get druggable targets OG5_140038	All targets in OG5_140038
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Retinal dehydrogenase 1, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Toxoplasma gondii	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Aldehyde dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Neospora caninum	hypothetical protein	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania infantum	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania donovani	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania mexicana	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Mycobacterium tuberculosis	Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1	aldehyde dehydrogenase 1 family, member A1	501 aa	456 aa	33.3 %
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
Onchocerca volvulus	Cathepsin L homolog	0.0346	0.3117	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0186	0.1371	0.247
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0541	0.0974
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0541	0.0974
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0237	0.1926	0.347
Trypanosoma cruzi	cysteine peptidase, putative	0.0346	0.3117	0.5467
Echinococcus multilocularis	tumor protein p63	0.0408	0.3788	0.3695
Toxoplasma gondii	cathepsin CPC1	0.0076	0.0181	0.0111
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Onchocerca volvulus		0.0076	0.0181	0.0581
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0076	0.0181	0.0326
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0541	0.0974
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0237	0.1926	0.5946
Loa Loa (eye worm)	cysteine protease	0.0346	0.3117	0.5614
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.0148	0.0266
Trypanosoma cruzi	cysteine peptidase, putative	0.0109	0.0541	0.067
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0186	0.1371	0.4054
Echinococcus granulosus	tumor protein p63	0.0408	0.3788	0.6737
Brugia malayi	Cathepsin L-like precursor	0.0237	0.1926	0.3464
Echinococcus multilocularis	cathepsin L	0.0186	0.1371	0.1242
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0005	0.0009
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0186	0.1371	0.4054
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0076	0.0181	0.0111
Trypanosoma cruzi	cysteine peptidase, putative	0.0346	0.3117	0.5467
Brugia malayi	Papain family cysteine protease containing protein	0.0346	0.3117	0.561
Loa Loa (eye worm)	hypothetical protein	0.0237	0.1926	0.347
Schistosoma mansoni	cathepsin F (C01 family)	0.0237	0.1926	0.347
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Giardia lamblia	Cathepsin B precursor	0.0229	0.1842	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.057	0.5551	1
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Onchocerca volvulus	Cathepsin L homolog	0.0346	0.3117	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0237	0.1926	0.5946
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Echinococcus multilocularis	cysteine protease	0.0346	0.3117	0.3013
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0229	0.1842	0.2697
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Echinococcus granulosus	cysteine protease	0.0186	0.1371	0.2264
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0076	0.0181	0.0326
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Echinococcus granulosus	cathepsin L	0.0186	0.1371	0.2264
Entamoeba histolytica	cysteine protease, putative	0.0346	0.3117	1
Entamoeba histolytica	cysteine proteinase, putative	0.0346	0.3117	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0186	0.1371	0.247
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.057	0.5551	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0186	0.1371	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0346	0.3117	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0109	0.0541	0.0965
Onchocerca volvulus		0.0346	0.3117	1
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0346	0.3117	0.5467
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Brugia malayi	Papain family cysteine protease containing protein	0.0076	0.0181	0.0317
Brugia malayi	fibroinase precursor	0.0076	0.0181	0.0317
Echinococcus granulosus	cathepsin l1	0.0237	0.1926	0.3292
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0346	0.3117	0.5494
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Entamoeba histolytica	cysteine proteinase, putative	0.0186	0.1371	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Plasmodium vivax	vivapain-3	0.0186	0.1371	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0186	0.1371	0.2216
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0109	0.0541	0.0974
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.057	0.5551	1
Brugia malayi	cathepsin B-like cysteine proteinase	0.057	0.5551	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0186	0.1371	0.2216
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Echinococcus granulosus	cathepsin b	0.057	0.5551	1
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Brugia malayi	Papain family cysteine protease containing protein	0.0186	0.1371	0.2463
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0076	0.0181	0.0326
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.057	0.5551	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0109	0.0541	0.067
Loa Loa (eye worm)	hypothetical protein	0.006	0.0005	0.0009
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Entamoeba histolytica	cysteine proteinase, putative	0.0237	0.1926	0.5946
Onchocerca volvulus		0.0346	0.3117	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0186	0.1371	0.247
Brugia malayi	cathepsin L-like precursor	0.0237	0.1926	0.3464
Schistosoma mansoni	cathepsin B (C01 family)	0.0076	0.0181	0.0326
Trypanosoma cruzi	cysteine protease, putative	0.0186	0.1371	0.2216
Schistosoma mansoni	cathepsin S (C01 family)	0.0076	0.0181	0.0326
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0346	0.3117	0.3013
Schistosoma mansoni	cathepsin F (C01 family)	0.0346	0.3117	0.5614
Brugia malayi	Papain family cysteine protease containing protein	0.0076	0.0181	0.0317
Onchocerca volvulus		0.0346	0.3117	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Leishmania major	cysteine peptidase A (CPA)	0.0346	0.3117	1
Schistosoma mansoni	cathepsin C	0.0076	0.0181	0.0326
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Onchocerca volvulus		0.0346	0.3117	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0076	0.0181	0.0317
Echinococcus granulosus	cathepsin L cysteine protease	0.0186	0.1371	0.2264
Echinococcus granulosus	cathepsin l1	0.0346	0.3117	0.5494
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Loa Loa (eye worm)	fibroinase	0.0346	0.3117	0.5614
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Echinococcus multilocularis	cathepsin b	0.057	0.5551	0.5484
Plasmodium vivax	vivapain-2	0.0346	0.3117	1
Brugia malayi	Cathepsin L-like precursor	0.0109	0.0541	0.0965
Brugia malayi	cathepsin L-like cysteine proteinase	0.0076	0.0181	0.0317
Brugia malayi	cathepsin F-like cysteine proteinase	0.0076	0.0181	0.0317
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0346	0.3117	0.5614
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0229	0.1842	0.5658
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0346	0.3117	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0346	0.3117	0.5494
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0237	0.1926	0.3464
Toxoplasma gondii	cathepsin B	0.0229	0.1842	0.5706
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0229	0.1842	0.5706
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0076	0.0181	0.0326
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0076	0.0181	0.0317
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0346	0.3117	0.3013
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0346	0.3117	1
Entamoeba histolytica	cysteine proteinase, putative	0.0186	0.1371	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.0076	0.0181	0.0317
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Onchocerca volvulus	Cathepsin F homolog	0.0346	0.3117	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0346	0.3117	0.3013
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0076	0.0181	0.0326
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0148	0.5
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.0148	0.0266
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0076	0.0181	0.0326
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Onchocerca volvulus		0.0346	0.3117	1
Onchocerca volvulus		0.0237	0.1926	0.6181
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0148	0.5
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0076	0.0181	0.0326
Entamoeba histolytica	cysteine proteinase 1, putative	0.0186	0.1371	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0076	0.0181	0.0326
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Plasmodium vivax	vivapain-2	0.0346	0.3117	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0346	0.3117	0.3013
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0346	0.3117	0.5614
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Loa Loa (eye worm)	ctsf protein	0.0346	0.3117	0.5614
Brugia malayi	Cathepsin L-like precursor	0.0237	0.1926	0.3464
Echinococcus multilocularis	cysteine protease	0.0346	0.3117	0.3013
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0076	0.0181	0.0326
Schistosoma mansoni	cathepsin s	0.0109	0.0541	0.0974
Giardia lamblia	Cathepsin B precursor	0.0229	0.1842	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0186	0.1371	0.2216
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0076	0.0181	0.0326
Onchocerca volvulus	Cathepsin L homolog	0.0076	0.0181	0.0581
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0109	0.0541	0.0965
Plasmodium vivax	unspecified product	0.0109	0.0541	0.1225
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0181	0.0326
Giardia lamblia	Cathepsin B precursor	0.0229	0.1842	1
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.057	0.5551	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0076	0.0181	0.0326
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0148	0.5
Loa Loa (eye worm)	hypothetical protein	0.057	0.5551	1
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0076	0.0181	0.0317
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0346	0.3117	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0186	0.1371	0.2216
Echinococcus multilocularis	cathepsin b	0.057	0.5551	0.5484
Echinococcus granulosus	cathepsin b	0.057	0.5551	1
Brugia malayi	Papain family cysteine protease containing protein	0.0186	0.1371	0.2463
Loa Loa (eye worm)	hypothetical protein	0.0237	0.1926	0.347
Brugia malayi	cathepsin L precursor	0.0076	0.0181	0.0317
Loa Loa (eye worm)	cathepsin B	0.0229	0.1842	0.3318
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0346	0.3117	1
Toxoplasma gondii	cathepsin CPL	0.0346	0.3117	1
Onchocerca volvulus		0.0346	0.3117	1
Plasmodium vivax	vivapain-1	0.0186	0.1371	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0186	0.1371	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0346	0.3117	0.561
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0346	0.3117	1
Onchocerca volvulus		0.0346	0.3117	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0346	0.3117	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0229	0.1842	0.3093
Echinococcus multilocularis	cathepsin L	0.0076	0.0181	0.0034
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Toxoplasma gondii	cathepsin CPC2	0.0076	0.0181	0.0111
Plasmodium vivax	unspecified product	0.0186	0.1371	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0076	0.0181	0.0326
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.0346	0.3117	0.5467
Entamoeba histolytica	cysteine proteinase 2	0.0186	0.1371	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0346	0.3117	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0229	0.1842	0.3318
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0237	0.1926	0.325
Loa Loa (eye worm)	hypothetical protein	0.0346	0.3117	0.5614
Leishmania major	cathepsin L-like protease	0.0346	0.3117	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0346	0.3117	0.5467
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0073	0.0148	0.5
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.0346	0.3117	0.5614
Entamoeba histolytica	cysteine proteinase, putative	0.0186	0.1371	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0186	0.1371	0.4054
Echinococcus granulosus	cathepsin L	0.0076	0.0181	0.0061
Entamoeba histolytica	cysteine proteinase, putative	0.0346	0.3117	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	10 uM	PUBCHEM_BIOASSAY: qHTS assay for re-activators of p53 using a Luc reporter. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504709]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	11.2202 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)	= 14.1254 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (functional)	16.3601 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143]	ChEMBL.	No reference
Potency (functional)	44.6684 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

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

Annotated phenotypes:

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

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

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

External resources for this compound

ChEMBL: CHEMBL3213746

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1890420