TDR Targets

Basic information

Technical information

TDR Targets ID: 1245424
Name: 2-(1-methyl-3-methylsulfanylindol-2-yl)-N-phe nylacetamide
MW: 310.413 | Formula: C18H18N2OS
H donors: 1 H acceptors: 1 LogP: 3.32 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CSc1c(CC(=O)Nc2ccccc2)n(c2c1cccc2)C
InChi: 1S/C18H18N2OS/c1-20-15-11-7-6-10-14(15)18(22-2)16(20)12-17(21)19-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3,(H,19,21)
InChiKey: CMQCILKLCYYXPO-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

2-(1-methyl-3-methylsulfanyl-indol-2-yl)-N-phenyl-acetamide
2-[1-methyl-3-(methylthio)-2-indolyl]-N-phenylacetamide
2-[1-methyl-3-(methylthio)indol-2-yl]-N-phenyl-acetamide
2-(1-methyl-3-methylsulfanyl-indol-2-yl)-N-phenyl-ethanamide
Oprea1_677166
ZINC00036668
BAS 01507363
2-[1-Methyl-3-(methylsulfanyl)-1H-indol-2-yl]-N-phenylacetamide
Acetamide, 2-(1-methyl-3-methylthioindol-2-yl)-N-phenyl-
2-(1-Methyl-3-methylsulfanyl-1H-indol-2-yl)-N-phenyl-acetamide
Oprea1_420535
ST001919
TimTec1_000023

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed), beta	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma congolense	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Mycobacterium ulcerans	hypothetical protein	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania infantum	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Leishmania donovani	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	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
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Leishmania braziliensis	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
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
Echinococcus multilocularis	guanine nucleotide binding protein G(s) 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
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma brucei gambiense	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania major	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Mycobacterium tuberculosis	Conserved hypothetical protein	Get druggable targets OG5_130965	All targets in OG5_130965
Leishmania mexicana	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma brucei	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965

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 %
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	polymerase (DNA directed), beta	335 aa	303 aa	32.3 %
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
Brugia malayi	beta-lactamase	0.0042	0.0249	0.0572
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0025	0.0045	0.0106
Mycobacterium tuberculosis	Conserved protein	0.0042	0.0249	0.0791
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0042	0.0249	0.0572
Trichomonas vaginalis	esterase, putative	0.0042	0.0249	0.0633
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.003	0.0101	0.0237
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0062	0.0505	0.1189
Brugia malayi	hypothetical protein	0.0032	0.0123	0.0282
Trypanosoma brucei	calpain-like protein, putative	0.013	0.1342	0.3159
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0173	0.1869	0.4399
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0365	0.4249	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0415	0.0415
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0042	0.0249	0.0791
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0415	0.0415
Mycobacterium ulcerans	esterase/lipase LipP	0.0042	0.0249	0.1143
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0022	0.0009	0.0009
Trichomonas vaginalis	penicillin-binding protein, putative	0.0042	0.0249	0.0633
Trichomonas vaginalis	importin beta-1, putative	0.0028	0.0077	0.0195
Brugia malayi	beta-lactamase family protein	0.0042	0.0249	0.0572
Entamoeba histolytica	hypothetical protein	0.003	0.0101	0.0255
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0025	0.0045	0.0103
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0025	0.0045	0.0106
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0415	0.0415
Loa Loa (eye worm)	hypothetical protein	0.0181	0.1967	0.4511
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0173	0.1869	0.4399
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0049	0.0112
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0028	0.0077	0.0195
Trichomonas vaginalis	D-aminoacylase, putative	0.0042	0.0249	0.0633
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0042	0.0249	0.0249
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0022	0.0009	0.0022
Plasmodium vivax	hypothetical protein, conserved	0.0042	0.0249	1
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0025	0.0045	0.1489
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.0269	0.0269
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0368	0.4287	0.9828
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0166	0.1787	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.034	0.394	1
Echinococcus multilocularis	protein quaking	0.0032	0.0123	0.0123
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0477	0.1093
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0173	0.1869	0.4399
Brugia malayi	tumor suppressor.	0.0374	0.4362	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0022	0.0009	0.5
Loa Loa (eye worm)	hypothetical protein	0.006	0.0477	0.1093
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.013	0.1342	0.3159
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.034	0.394	1
Trichomonas vaginalis	ap endonuclease, putative	0.0022	0.0009	0.0023
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0022	0.0009	0.0022
Leishmania major	importin beta-1 subunit, putative	0.0028	0.0077	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Trichomonas vaginalis	D-aminoacylase, putative	0.0042	0.0249	0.0633
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.013	0.1342	0.3159
Schistosoma mansoni	importin beta-1	0.0034	0.0158	0.0158
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Schistosoma mansoni	hypothetical protein	0.0041	0.0241	0.0241
Mycobacterium tuberculosis	Conserved protein	0.0042	0.0249	0.0791
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0042	0.0249	0.0249
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0042	0.0249	0.1143
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0158	0.0361
Trichomonas vaginalis	ap endonuclease, putative	0.0022	0.0009	0.0023
Mycobacterium tuberculosis	Conserved protein	0.0042	0.0249	0.0791
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0022	0.0001	0.0001
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0028	0.0077	0.0181
Toxoplasma gondii	hypothetical protein	0.0059	0.046	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0026	0.0049	0.0115
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.0269	0.0269
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0025	0.0045	0.0106
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.0269	0.0269
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0415	0.0415
Schistosoma mansoni	hypothetical protein	0.0043	0.0269	0.0269
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0365	0.4249	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.013	0.1342	0.3159
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0166	0.1787	0.8459
Mycobacterium ulcerans	lipase LipD	0.0042	0.0249	0.1143
Schistosoma mansoni	microtubule-associated protein tau	0.0829	1	1
Entamoeba histolytica	hypothetical protein	0.0043	0.0269	0.0683
Giardia lamblia	Fructose-bisphosphate aldolase	0.034	0.394	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0241	0.0552
Trypanosoma brucei	hypothetical protein	0.013	0.1342	0.3159
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Toxoplasma gondii	exonuclease III APE	0.0022	0.0009	0.0201
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0051	0.0366	0.0862
Trichomonas vaginalis	penicillin-binding protein, putative	0.0042	0.0249	0.0633
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0051	0.0366	0.0862
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0022	0.0009	0.0022
Trypanosoma cruzi	hypothetical protein, conserved	0.0042	0.0249	0.0587
Loa Loa (eye worm)	beta-lactamase	0.0042	0.0249	0.0572
Echinococcus granulosus	snurportin 1	0.0368	0.4287	0.4287
Mycobacterium tuberculosis	Probable hydrolase	0.0042	0.0249	0.0791
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.013	0.1342	0.3159
Brugia malayi	hypothetical protein	0.0043	0.0269	0.0617
Entamoeba histolytica	Ran family GTPase	0.0025	0.0045	0.0114
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0025	0.0045	0.2408
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0025	0.0045	0.0103
Leishmania major	hypothetical protein, conserved	0.0042	0.0249	0.0587
Echinococcus granulosus	serine protein kinase ATM	0.003	0.0101	0.0101
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Schistosoma mansoni	hypothetical protein	0.0032	0.0123	0.0123
Brugia malayi	hypothetical protein	0.0181	0.1967	0.4511
Trypanosoma brucei	variant surface glycoprotein (VSG), putative	0.013	0.1342	0.3159
Mycobacterium tuberculosis	Probable lipase LipE	0.0042	0.0249	0.0791
Trichomonas vaginalis	ran, putative	0.0025	0.0045	0.0114
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0365	0.4249	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Brugia malayi	RNA, U transporter 1	0.0098	0.0945	0.2165
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0042	0.0249	0.0572
Mycobacterium tuberculosis	Probable esterase LipL	0.0042	0.0249	0.0791
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.003	0.0101	0.0237
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Entamoeba histolytica	hypothetical protein	0.0043	0.0269	0.0683
Leishmania major	GTP-binding protein, putative	0.0025	0.0045	0.0106
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0022	0.0009	0.0023
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0022	0.0009	0.0009
Brugia malayi	exodeoxyribonuclease III family protein	0.0022	0.0009	0.0021
Echinococcus granulosus	beta LACTamase domain containing family member	0.0042	0.0249	0.0249
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0415	0.0952
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0022	0.0001	0.0001
Echinococcus granulosus	protein quaking	0.0032	0.0123	0.0123
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Brugia malayi	Importin beta-1 subunit	0.0034	0.0158	0.0361
Trichomonas vaginalis	D-aminoacylase, putative	0.0042	0.0249	0.0633
Mycobacterium ulcerans	hypothetical protein	0.0042	0.0249	0.1143
Schistosoma mansoni	hypothetical protein	0.0032	0.0123	0.0123
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Entamoeba histolytica	hypothetical protein	0.0028	0.0077	0.0195
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0025	0.0045	0.0045
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0025	0.0045	0.0114
Entamoeba histolytica	hypothetical protein	0.0043	0.0269	0.0683
Schistosoma mansoni	ran	0.0025	0.0045	0.0045
Brugia malayi	beta-lactamase family protein	0.0042	0.0249	0.0572
Treponema pallidum	fructose-bisphosphate aldolase	0.034	0.394	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.003	0.0101	0.023
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0192	0.2111	0.6926
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Brugia malayi	Temporarily assigned gene name protein 44	0.0032	0.0123	0.0282
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0415	0.0952
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0051	0.0366	0.0862
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0051	0.0366	0.0862
Mycobacterium ulcerans	hypothetical protein	0.0192	0.2111	1
Trypanosoma brucei	hypothetical protein, conserved	0.0042	0.0249	0.0587
Echinococcus multilocularis	serine protein kinase ATM	0.003	0.0101	0.0101
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0415	0.0415
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0022	0.0009	0.0023
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0415	0.0415
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.003	0.0101	0.0101
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0025	0.0045	0.0045
Toxoplasma gondii	HEAT repeat-containing protein	0.0034	0.0158	0.343
Plasmodium falciparum	importin beta, putative	0.0034	0.0158	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.0477	0.1093
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0042	0.0249	0.0791
Mycobacterium ulcerans	beta-lactamase	0.0042	0.0249	0.1143
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0042	0.0249	0.0249
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Schistosoma mansoni	ap endonuclease	0.0022	0.0009	0.0009
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0415	0.0415
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0022	0.0009	0.0021
Echinococcus granulosus	hypothetical protein	0.0032	0.0123	0.0123
Schistosoma mansoni	ran	0.0025	0.0045	0.0045
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0267	0.3043	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0042	0.0249	0.0587
Mycobacterium tuberculosis	Probable lipase LipD	0.0042	0.0249	0.0791
Schistosoma mansoni	hypothetical protein	0.0368	0.4287	0.4287
Toxoplasma gondii	FATC domain-containing protein	0.003	0.0101	0.2187
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.013	0.1342	0.3159
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0025	0.0045	0.0979
Onchocerca volvulus		0.0181	0.1967	1
Trypanosoma brucei	importin beta-1 subunit, putative	0.0034	0.0158	0.0371
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.013	0.1342	0.3159
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0028	0.0077	0.0195
Echinococcus multilocularis	microtubule associated protein 2	0.0829	1	1
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.013	0.1342	0.3159
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0022	0.0009	0.0022
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Leishmania major	mitochondrial DNA polymerase beta	0.0365	0.4249	1
Schistosoma mansoni	ap endonuclease	0.0022	0.0009	0.0009
Echinococcus granulosus	importin subunit beta 1	0.0034	0.0158	0.0158
Trypanosoma brucei	importin beta-1 subunit, putative	0.0034	0.0158	0.0371
Entamoeba histolytica	hypothetical protein	0.0043	0.0269	0.0683
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0241	0.0552
Echinococcus multilocularis	snurportin 1	0.0368	0.4287	0.4287
Trypanosoma brucei	calpain, putative	0.013	0.1342	0.3159
Loa Loa (eye worm)	tumor suppressor	0.0374	0.4362	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0249	0.0572
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0166	0.1787	0.5859
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.034	0.394	1
Echinococcus multilocularis	importin subunit beta 1	0.0034	0.0158	0.0158
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0042	0.0249	0.0791
Plasmodium vivax	importin-beta 2, putative	0.0034	0.0158	0.6181
Toxoplasma gondii	ABC1 family protein	0.0042	0.0249	0.5425
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0123	0.0282
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.0477	0.1093
Trichomonas vaginalis	PIKK family atypical protein kinase	0.003	0.0101	0.0255

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.1853 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)	1.122 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 3.1623 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	8.1995 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	10 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)	10.4179 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)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	20.5878 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 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

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: CHEMBL1333534

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1245424