TDR Targets

Basic information

Technical information

TDR Targets ID: 1416345
Name: 1-acetyl-N-(4-methylphenyl)-5-piperidin-1-yls ulfonyl-2,3-dihydroindole-2-carboxamide
MW: 441.543 | Formula: C23H27N3O4S
H donors: 1 H acceptors: 4 LogP: 2.61 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1)NC(=O)C1Cc2c(N1C(=O)C)ccc(c2)S(=O)(=O)N1CCCCC1
InChi: 1S/C23H27N3O4S/c1-16-6-8-19(9-7-16)24-23(28)22-15-18-14-20(10-11-21(18)26(22)17(2)27)31(29,30)25-12-4-3-5-13-25/h6-11,14,22H,3-5,12-13,15H2,1-2H3,(H,24,28)
InChiKey: CKMZWGXTZNJTBT-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

1-acetyl-N-(4-methylphenyl)-5-(1-piperidylsulfonyl)indoline-2-carboxamide
1-acetyl-N-(4-methylphenyl)-5-(1-piperidylsulfonyl)-2-indolinecarboxamide
1-acetyl-N-(4-methylphenyl)-5-piperidinosulfonyl-indoline-2-carboxamide
1-ethanoyl-N-(4-methylphenyl)-5-piperidin-1-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	APEX nuclease (multifunctional DNA repair enzyme) 1	Starlite/ChEMBL	No references
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
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	Get druggable targets OG5_126768	All targets in OG5_126768
Entamoeba histolytica	exodeoxyribonuclease III, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium hominis	dna-(apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium knowlesi	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Toxoplasma gondii	exonuclease III APE	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium yoelii	putative AP endonuclease-related	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania donovani	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma congolense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium berghei	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei gambiense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium parvum	conserved hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania braziliensis	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Theileria parva	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi	exonuclease III	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania infantum	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania mexicana	apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10772 AP endonuclease 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	Get druggable targets OG5_126768	All targets in OG5_126768
Treponema pallidum	exodeoxyribonuclease (exoA)	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10771 AP endonuclease 1, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
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
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Echinococcus granulosus	Cell division cycle 2 protein kinase	0.0062	0.0667	0.1229
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Leishmania major	protein kinase, putative,dual-specificity protein kinase, putative	0.0267	0.4147	1
Brugia malayi	hypothetical protein	0.0043	0.0346	0.0637
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	hypothetical protein	0.0105	0.1397	0.2553
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	haspin protein kinase	0.0342	0.5423	0.9911
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Plasmodium falciparum	protoporphyrinogen oxidase	0.0043	0.0346	0.2113
Chlamydia trachomatis	protoporphyrinogen oxidase	0.0043	0.0346	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Echinococcus multilocularis		0.0043	0.0346	0.0637
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Schistosoma mansoni	amine oxidase	0.0043	0.0346	0.0637
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Giardia lamblia	Kinase, CAMK CAMKL	0.0062	0.0667	0.1607
Entamoeba histolytica	protein kinase, putative	0.0108	0.1445	0.3486
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0043	0.0346	0.0346
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0346	0.2113
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0043	0.0346	0.2113
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	microfilarial chitinase	0.0073	0.0854	0.156
Trichomonas vaginalis	G protein-coupled receptor kinase, putative	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trypanosoma brucei	Mitogen-activated protein kinase 10, putative	0.0062	0.0667	0.1607
Schistosoma mansoni	hypothetical protein	0.0342	0.5423	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Mycobacterium tuberculosis	Possible oxidoreductase	0.0043	0.0346	0.0373
Schistosoma mansoni	amine oxidase	0.0043	0.0346	0.0637
Trichomonas vaginalis	serine/threonine kinase, putative	0.0062	0.0667	0.1607
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Plasmodium falciparum	MO15-related protein kinase	0.0062	0.0667	0.4075
Mycobacterium ulcerans	chitinase/cellulase	0.0064	0.07	0.07
Entamoeba histolytica	protein kinase, putative	0.0267	0.4147	1
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0043	0.0346	0.2113
Echinococcus multilocularis	dual specificity	0.0108	0.1445	0.2665
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Echinococcus granulosus	mitogen activated protein kinase 15	0.0062	0.0667	0.1229
Giardia lamblia	Kinase, CAMK CAMKL	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	hypothetical protein	0.0119	0.1636	0.299
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Toxoplasma gondii	hypothetical protein	0.0119	0.1636	0.3945
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0637	0.1164
Entamoeba histolytica	protein kinase domain containing protein	0.0062	0.0667	0.1607
Echinococcus granulosus	serine:threonine protein kinase haspin	0.0342	0.5423	1
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0043	0.0346	0.0637
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0043	0.0346	0.0373
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0043	0.0346	0.2113
Entamoeba histolytica	protein kinase domain containing protein	0.0108	0.1445	0.3486
Giardia lamblia	Kinase, CAMK CAMKL	0.0062	0.0667	0.1607
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0043	0.0346	0.0834
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0062	0.0667	0.1218
Echinococcus multilocularis	serine:threonine protein kinase haspin	0.0342	0.5423	1
Echinococcus granulosus	dual specificity	0.0267	0.4147	0.7646
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0346	0.2113
Mycobacterium ulcerans	oxidoreductase	0.0043	0.0346	0.0346
Loa Loa (eye worm)	cuticular endochitinase	0.0075	0.0888	0.1622
Echinococcus granulosus	dual specificity	0.0108	0.1445	0.2665
Entamoeba histolytica	hypothetical protein	0.0108	0.1445	0.3486
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0043	0.0346	0.0637
Plasmodium vivax	serine/threonine protein kinase KIN, putative	0.0062	0.0667	0.4075
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trypanosoma cruzi	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.0267	0.4147	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Schistosoma mansoni	serine/threonine protein kinase	0.0062	0.0667	0.1229
Onchocerca volvulus		0.0119	0.1636	1
Loa Loa (eye worm)	chitinase I	0.0075	0.0888	0.1622
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0043	0.0346	0.0637
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	protein kinase atmrk1, putative	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0667	0.1607
Plasmodium vivax	hypothetical protein, conserved	0.0119	0.1636	1
Schistosoma mansoni	hypothetical protein	0.0059	0.0618	0.114
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Mycobacterium ulcerans	chitinase/cellulase	0.0064	0.07	0.07
Trypanosoma cruzi	serine/threonine protein kinase, putative	0.0062	0.0667	0.1607
Loa Loa (eye worm)	CMGC/CDK/CRK7 protein kinase	0.0062	0.0667	0.1218
Leishmania major	UDP-galactopyranose mutase	0.0043	0.0346	0.0834
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0023	0	0.5
Plasmodium vivax	cyclin dependent kinase 7 (cdk7), putative	0.0062	0.0667	0.4075
Schistosoma mansoni	serine/threonine kinase	0.0062	0.0667	0.1229
Onchocerca volvulus	Putative endochitinase	0.0075	0.0888	0.4201
Onchocerca volvulus	Putative endochitinase	0.0075	0.0888	0.4201
Entamoeba histolytica	hypothetical protein	0.0059	0.0618	0.1491
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trypanosoma brucei	CMGC/DYRK protein kinase, putative	0.0108	0.1445	0.3486
Echinococcus granulosus	Pfam-B_8186 domain containing protein	0.0059	0.0618	0.114
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0108	0.1445	0.3486
Echinococcus multilocularis	dual specificity	0.0267	0.4147	0.7646
Brugia malayi	Cell division protein kinase 2	0.0062	0.0667	0.1229
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0043	0.0346	0.0637
Entamoeba histolytica	cell division protein kinase 2, putative	0.0062	0.0667	0.1607
Schistosoma mansoni	protein kinase	0.0062	0.0667	0.1229
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Entamoeba histolytica	chitinase, putative	0.0075	0.0888	0.2141
Mycobacterium tuberculosis	Possible chitinase	0.0064	0.07	0.0755
Echinococcus multilocularis	dual specificity	0.0267	0.4147	0.7646
Brugia malayi	Protein kinase domain containing protein	0.0062	0.0667	0.1229
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0043	0.0346	0.0834
Trypanosoma brucei	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.0267	0.4147	1
Echinococcus multilocularis	cyclin dependent kinase 9	0.0062	0.0667	0.1229
Echinococcus multilocularis	serine:threonine protein kinase NLK	0.0062	0.0667	0.1229
Loa Loa (eye worm)	hypothetical protein	0.0064	0.07	0.128
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0043	0.0346	0.0637
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Echinococcus granulosus	Hepatocellular carcinoma associated antigen 59	0.0119	0.1636	0.3016
Loa Loa (eye worm)	hypothetical protein	0.0119	0.1636	0.299
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.0637	0.1174
Echinococcus multilocularis	dual specificity	0.0267	0.4147	0.7646
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	endochitinase	0.0075	0.0888	0.1637
Echinococcus granulosus	dual specificity	0.0267	0.4147	0.7646
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0108	0.1445	0.3486
Onchocerca volvulus	Putative endochitinase	0.0084	0.1041	0.5391
Schistosoma mansoni	hypothetical protein	0.0041	0.0313	0.0578
Toxoplasma gondii	cell-cycle-associated protein kinase DYRK2, putative	0.0267	0.4147	1
Leishmania major	mitogen-activated protein kinase, putative,map kinase-like protein	0.0062	0.0667	0.1607
Schistosoma mansoni	hypothetical protein	0.0119	0.1636	0.3016
Brugia malayi	Dual-specificity tyrosine-phosphorylation regulated kinase 2	0.0267	0.4147	0.7646
Onchocerca volvulus		0.0119	0.1636	1
Leishmania major	chitinase	0.0075	0.0888	0.2141
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0611	1	1
Schistosoma mansoni	serine/threonine protein kinase	0.0108	0.1445	0.2665
Mycobacterium ulcerans	dehydrogenase	0.0043	0.0346	0.0346
Trypanosoma cruzi	Mitogen-activated protein kinase 10, putative	0.0062	0.0667	0.1607
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	hypothetical protein	0.0342	0.5423	1
Brugia malayi	cyclin-dependent kinase 7 homolog	0.0062	0.0667	0.1229
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	CMGC/DYRK/DYRK1 protein kinase	0.0108	0.1445	0.2642
Loa Loa (eye worm)	hypothetical protein	0.0105	0.1397	0.2553
Onchocerca volvulus	Putative endochitinase	0.0084	0.1041	0.5391
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0043	0.0346	0.2113
Onchocerca volvulus	Putative endochitinase	0.0084	0.1041	0.5391
Echinococcus granulosus	serine:threonine protein kinase NLK	0.0062	0.0667	0.1229
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0043	0.0346	0.0637
Trichomonas vaginalis	AGC family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Mycobacterium ulcerans	monoamine oxidase	0.0043	0.0346	0.0346
Entamoeba histolytica	protein kinase, putative	0.0108	0.1445	0.3486
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0313	0.0572
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	SWIRM domain containing protein	0.0043	0.0346	0.0637
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0667	0.1607
Echinococcus multilocularis	hypothetical protein	0.0059	0.0618	0.114
Echinococcus granulosus	cyclin dependent kinase 9	0.0062	0.0667	0.1229
Toxoplasma gondii	histone lysine-specific demethylase	0.0043	0.0346	0.0834
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0313	0.0578
Brugia malayi	Protein kinase domain containing protein	0.0108	0.1445	0.2665
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trypanosoma brucei	protein kinase, putative	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Echinococcus granulosus	dual specificity	0.0267	0.4147	0.7646
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Giardia lamblia	Kinase, CMGC DYRK	0.0267	0.4147	1
Echinococcus granulosus	serine:threonine protein kinase haspin	0.0342	0.5423	1
Trypanosoma cruzi	Mitogen-activated protein kinase 10, putative	0.0062	0.0667	0.1607
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0346	0.0632
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	Endochitinase	0.0084	0.1041	0.192
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0043	0.0346	0.0834
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	GSG2	0.0342	0.5423	1
Plasmodium falciparum	conserved protein, unknown function	0.0119	0.1636	1
Brugia malayi	Hepatocellular carcinoma-associated antigen 59 family protein	0.0119	0.1636	0.3016
Echinococcus multilocularis	Hepatocellular carcinoma associated antigen 59	0.0119	0.1636	0.3016
Loa Loa (eye worm)	haspin protein kinase	0.0345	0.5472	1
Loa Loa (eye worm)	CMGC/DYRK/DYRK2 protein kinase	0.0267	0.4147	0.7579
Entamoeba histolytica	protein kinase domain containing protein	0.0267	0.4147	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.0637	0.1174
Trichomonas vaginalis	CMGC family protein kinase	0.0267	0.4147	1
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Leishmania major	serine/threonine-protein kinase, putative,protein kinase, putative	0.0108	0.1445	0.3486
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Echinococcus multilocularis	Cell division cycle 2 protein kinase	0.0062	0.0667	0.1229
Brugia malayi	amine oxidase, flavin-containing family protein	0.0043	0.0346	0.0637
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0043	0.0346	0.5
Brugia malayi	endochitinase	0.0084	0.1041	0.192
Echinococcus multilocularis	serine:threonine protein kinase haspin	0.0342	0.5423	1
Loa Loa (eye worm)	hypothetical protein	0.006	0.0637	0.1164
Echinococcus granulosus	serine:threonine protein kinase haspin	0.0342	0.5423	1
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0568	0.9269	1
Schistosoma mansoni	serine/threonine protein kinase	0.0267	0.4147	0.7646
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Loa Loa (eye worm)	haspin protein kinase	0.0342	0.5423	0.9911
Trichomonas vaginalis	CMGC family protein kinase	0.0062	0.0667	0.1607
Trichomonas vaginalis	CAMK family protein kinase	0.0062	0.0667	0.1607
Leishmania major	serine/threonine kinase-like protein, putative	0.0062	0.0667	0.1607

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	1.6834 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.6234 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (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, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	25.1189 uM	PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	25.1189 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	29.0929 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)	29.9349 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): 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: CHEMBL1572670

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1416345