TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 382.415 | Formula: C23H18N4O2
H donors: 1 H acceptors: 3 LogP: 3.52 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccccc1NC(=O)c1ccc(c(c1)C#Cc1cnc2n(c1)ncc2)C
InChi: 1S/C23H18N4O2/c1-16-7-9-19(23(28)26-20-5-3-4-6-21(20)29-2)13-18(16)10-8-17-14-24-22-11-12-25-27(22)15-17/h3-7,9,11-15H,1-2H3,(H,26,28)
InChiKey: INQIIYZNPFFIAO-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	discoidin domain receptor tyrosine kinase 1	Starlite/ChEMBL	References
Homo sapiens	discoidin domain receptor tyrosine kinase 2	Starlite/ChEMBL	References
Homo sapiens	v-kit Hardy-Zuckerman 4 feline sarcoma viral oncogene homolog	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	Get druggable targets OG5_132967	All targets in OG5_132967
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_130314	All targets in OG5_130314
Onchocerca volvulus		Get druggable targets OG5_130314	All targets in OG5_130314
Loa Loa (eye worm)	TK/DDR protein kinase	Get druggable targets OG5_130314	All targets in OG5_130314
Echinococcus granulosus	discoidin domain receptor	Get druggable targets OG5_130314	All targets in OG5_130314
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_130314	All targets in OG5_130314
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_130314	All targets in OG5_130314

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.003	0.0164	0.0412
Leishmania major	NAD dependent deacetylase, putative,transcriptional regulator, Sir2 family protein, nicotinic acid mononucleotide 5,6-dimethylbe	0.0036	0.0253	0.0091
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.002	0.0024	0.0045
Echinococcus multilocularis	CREB binding protein	0.0186	0.2493	0.4621
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.003	0.0164	0.0331
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.002	0.0024	0.0045
Brugia malayi	Plexin repeat family protein	0.0019	0.001	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0236	0.324	0.6005
Echinococcus granulosus	discoidin domain containing receptor 2	0.0033	0.0216	0.0222
Trypanosoma cruzi	cysteine peptidase, putative	0.003	0.0164	0.0124
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0159	0.2089	0.3872
Entamoeba histolytica	cysteine protease, putative	0.003	0.0164	0.0686
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.002	0.0024	0.0045
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.002	0.0024	0.0045
Trypanosoma brucei	Silent information regulator 2 related protein 3	0.0036	0.0253	0.0091
Giardia lamblia	NAD-dependent histone deacetylase Sir2	0.0271	0.3767	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Plasmodium vivax	LCCL domain-containing protein	0.0033	0.0216	0.0274
Onchocerca volvulus	Cathepsin L homolog	0.003	0.0164	0.0412
Loa Loa (eye worm)	plexin A	0.0023	0.0063	0.0117
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0157	0.2063	0.9591
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.003	0.0164	0.0303
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Brugia malayi	photoreceptor-specific nuclear receptor	0.002	0.0024	0.0045
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Schistosoma mansoni	plexin	0.0019	0.001	0.0018
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.002	0.0024	0.0045
Entamoeba histolytica	cysteine proteinase, putative	0.003	0.0164	0.0686
Schistosoma mansoni	coup transcription factor	0.002	0.0024	0.0045
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0159	0.2089	0.3872
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Brugia malayi	Papain family cysteine protease containing protein	0.003	0.0164	0.0303
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.002	0.0024	0.0045
Brugia malayi	Cathepsin L-like precursor	0.0021	0.004	0.0074
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0024	0.0045
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0689	1	1
Plasmodium falciparum	LCCL domain-containing protein	0.0033	0.0216	0.031
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.002	0.0024	0.0045
Loa Loa (eye worm)	cysteine protease	0.003	0.0164	0.0303
Toxoplasma gondii	histone deacetylase SIR2-like	0.0036	0.0253	0.0451
Schistosoma mansoni	nuclear hormone receptor	0.002	0.0024	0.0045
Loa Loa (eye worm)	ctsf protein	0.003	0.0164	0.0303
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0271	0.3767	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.002	0.0024	0.0045
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.002	0.0024	0.0038
Echinococcus granulosus	ecdysone induced protein 78C	0.002	0.0024	0.0025
Onchocerca volvulus	Bile acid receptor homolog	0.0193	0.2591	0.693
Toxoplasma gondii	F5/8 type C domain-containing protein	0.0033	0.0216	0.0263
Entamoeba histolytica	Sir2 family transcriptional regulator, putative	0.0036	0.0253	0.1182
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Brugia malayi	STAT protein, DNA binding domain containing protein	0.0291	0.4064	0.7533
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0159	0.2089	0.3872
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Schistosoma mansoni	RAR-like nuclear receptor	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0021	0.004	0.0074
Echinococcus multilocularis	cysteine protease	0.003	0.0164	0.0303
Echinococcus multilocularis	FTZ F1 alpha	0.002	0.0024	0.0045
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.002	0.0024	0.0045
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Schistosoma mansoni	CREB-binding protein 2	0.0221	0.3011	0.5582
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0157	0.2063	0.9591
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Schistosoma mansoni	dock	0.0033	0.0216	0.04
Loa Loa (eye worm)	cathepsin B	0.0056	0.0548	0.1017
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0056	0.0548	0.0391
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.002	0.0024	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0496	0.0919
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0056	0.0548	0.1364
Onchocerca volvulus		0.003	0.0164	0.0412
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 1	0.0271	0.3767	0.6984
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.002	0.0024	0.0045
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0065	0.012
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0024	0.0045
Schistosoma mansoni	steroid hormone receptor ad4bp	0.002	0.0024	0.0045
Schistosoma mansoni	CREB-binding protein 1 (SmCBP1)	0.0221	0.3011	0.5582
Trypanosoma brucei	SIR2-like protein 4, putative	0.0036	0.0253	0.0091
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0142	0.1833	0.1801
Giardia lamblia	Histone acetyltransferase GCN5	0.0142	0.1841	0.452
Brugia malayi	cathepsin B-like cysteine proteinase	0.0159	0.2089	0.3872
Brugia malayi	NAD-dependent deacetylase SIRT1	0.0271	0.3767	0.6984
Brugia malayi	TAZ zinc finger family protein	0.0221	0.3011	0.5582
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.002	0.0024	0.0025
Entamoeba histolytica	Sir2 family transcriptional regulator, putative	0.0036	0.0253	0.1182
Echinococcus granulosus	Coagulation factor 5 8 type C terminal	0.0033	0.0216	0.0222
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.002	0.0024	0.0045
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0024	0.0045
Echinococcus granulosus	cathepsin b	0.0159	0.2089	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0216	0.04
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.002	0.0024	0.0045
Echinococcus multilocularis	plexin a4	0.0023	0.0063	0.0117
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0142	0.1833	0.1698
Trypanosoma cruzi	Silent information regulator 2 related protein 3	0.0036	0.0253	0.0214
Loa Loa (eye worm)	TK/DDR protein kinase	0.0236	0.324	0.6005
Echinococcus granulosus	FTZ F1 alpha	0.002	0.0024	0.0025
Echinococcus granulosus	cathepsin L cysteine proteinase	0.003	0.0164	0.0168
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0477	0.6831	0.6779
Leishmania major	sir2-family protein-like protein	0.0036	0.0253	0.0091
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Echinococcus granulosus	plexin a4	0.0023	0.0063	0.0065
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.002	0.0024	0.0045
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Echinococcus multilocularis	discoidin domain receptor	0.0033	0.0216	0.04
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0477	0.6831	0.6779
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Brugia malayi	cathepsin L-like precursor	0.0021	0.004	0.0074
Onchocerca volvulus		0.0021	0.004	0.008
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0024	0.0045
Brugia malayi	ecdysteroid receptor	0.0193	0.2591	0.4803
Plasmodium vivax	hypothetical protein, conserved	0.0036	0.0253	0.047
Onchocerca volvulus		0.003	0.0164	0.0412
Echinococcus granulosus	NAD dependent deacetylase sirtuin 7	0.0036	0.0253	0.026
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Echinococcus granulosus	CREB binding protein	0.0178	0.2379	0.2446
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0024	0.0045
Echinococcus granulosus	cathepsin l1	0.0021	0.004	0.0041
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Echinococcus multilocularis	cathepsin L cysteine protease	0.003	0.0164	0.0303
Schistosoma mansoni	retinoic acid receptor RXR	0.002	0.0024	0.0045
Toxoplasma gondii	F5/8 type C domain-containing protein	0.0033	0.0216	0.0263
Loa Loa (eye worm)	sirtuin 4	0.0036	0.0253	0.0469
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0142	0.1833	0.1801
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Trichomonas vaginalis	hypothetical protein	0.0033	0.0216	0.0471
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0024	0.0045
Trypanosoma brucei	Silent information regulator 2 related protein 1	0.0036	0.0253	0.0091
Echinococcus granulosus	discoidin domain receptor	0.0265	0.3669	0.3773
Brugia malayi	nuclear hormone receptor	0.002	0.0024	0.0045
Entamoeba histolytica	Sir2 family transcriptional regulator, putative	0.0036	0.0253	0.1182
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0142	0.1833	0.1801
Schistosoma mansoni	discoidin domain receptor	0.0033	0.0216	0.04
Loa Loa (eye worm)	STAT protein	0.0291	0.4064	0.7533
Echinococcus multilocularis	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Brugia malayi	nuclear receptor NHR-88	0.002	0.0024	0.0045
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0159	0.2089	0.3872
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.002	0.0024	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.002	0.0024	0.0045
Echinococcus granulosus	cathepsin l1	0.003	0.0164	0.0168
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0024	0.0045
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0056	0.0548	0.0391
Onchocerca volvulus		0.003	0.0164	0.0412
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0056	0.0548	0.1017
Echinococcus granulosus	CREB binding protein	0.0221	0.3011	0.3097
Echinococcus multilocularis	nuclear receptor 2C2 associated protein	0.0033	0.0216	0.04
Echinococcus granulosus	NAD dependent deacetylase sirtuin 1	0.0271	0.3767	0.3874
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0056	0.0548	0.051
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Loa Loa (eye worm)	acetyltransferase	0.0381	0.5395	1
Plasmodium falciparum	LCCL domain-containing protein	0.0033	0.0216	0.031
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0024	0.0045
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.002	0.0024	0.0025
Toxoplasma gondii	hypothetical protein	0.0163	0.2144	1
Entamoeba histolytica	cysteine proteinase, putative	0.003	0.0164	0.0686
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Mycobacterium leprae	PROBABLE CONSERVED TRANSMEMBRANE PROTEIN	0.0033	0.0216	0.5
Onchocerca volvulus	Protein ultraspiracle homolog	0.002	0.0024	0.0038
Schistosoma mansoni	cathepsin F (C01 family)	0.003	0.0164	0.0303
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0157	0.2063	0.5427
Onchocerca volvulus	Cathepsin L homolog	0.003	0.0164	0.0412
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0364	0.5145	0.5291
Brugia malayi	Protein kinase domain containing protein	0.0269	0.3734	0.6922
Trichomonas vaginalis	alpha-L-fucosidase, putative	0.0033	0.0216	0.0471
Echinococcus multilocularis	cathepsin L cysteine protease	0.003	0.0164	0.0303
Echinococcus granulosus	cathepsin l cysteine peptidase	0.003	0.0164	0.0168
Loa Loa (eye worm)	fibroinase	0.003	0.0164	0.0303
Trichomonas vaginalis	alpha-L-fucosidase, putative	0.0033	0.0216	0.0471
Trypanosoma cruzi	cysteine peptidase, putative	0.003	0.0164	0.0124
Schistosoma mansoni	cathepsin F (C01 family)	0.003	0.0164	0.0303
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Trypanosoma cruzi	Silent information regulator 2 related protein 3	0.0036	0.0253	0.0214
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0689	1	1
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Echinococcus granulosus	NAD dependent deacetylase sirtuin 3	0.0036	0.0253	0.026
Schistosoma mansoni	chromatin regulatory protein sir2	0.0271	0.3767	0.6984
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.002	0.0024	0.0045
Echinococcus multilocularis	Coagulation factor 5 8 type, C terminal	0.0033	0.0216	0.04
Toxoplasma gondii	histone deacetylase SIR2	0.0036	0.0253	0.0451
Leishmania major	silent information regulator 2, putative	0.0036	0.0253	0.0091
Loa Loa (eye worm)	hypothetical protein	0.003	0.0164	0.0303
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0689	1	1
Brugia malayi	transcriptional regulator, Sir2 family protein	0.0036	0.0253	0.0469
Echinococcus granulosus	NAD dependent deacetylase sirtuin 6	0.0036	0.0253	0.026
Toxoplasma gondii	PA14 domain-containing protein	0.0033	0.0216	0.0263
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0157	0.2063	0.5427
Trypanosoma cruzi	Silent information regulator 2 related protein 1	0.0036	0.0253	0.0214
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0271	0.3767	1
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0381	0.5395	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.002	0.0024	0.0045
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0157	0.2063	1
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 6	0.0036	0.0253	0.0469
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.002	0.0024	0.0025
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Entamoeba histolytica	hypothetical protein, conserved	0.0036	0.0253	0.1182
Echinococcus multilocularis	cathepsin b	0.0159	0.2089	0.3872
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.002	0.0024	0.0045
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0477	0.6831	0.6818
Schistosoma mansoni	btb and poz domain-containing protein	0.0033	0.0216	0.04
Plasmodium falciparum	transcriptional regulatory protein sir2b	0.0036	0.0253	0.0532
Echinococcus granulosus	discoidin domain containing receptor 2	0.0033	0.0216	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0236	0.3235	0.5997
Schistosoma mansoni	septate junction protein	0.0033	0.0216	0.04
Echinococcus granulosus	chromatin regulatory protein sir2	0.0036	0.0253	0.026
Onchocerca volvulus		0.003	0.0164	0.0412
Onchocerca volvulus		0.002	0.0024	0.0038
Brugia malayi	plexin A	0.0023	0.0063	0.0117
Loa Loa (eye worm)	steroid hormone receptor	0.002	0.0024	0.0045
Schistosoma mansoni	hypothetical protein	0.0033	0.0216	0.04
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.003	0.0164	0.0303
Echinococcus multilocularis	ecdysone induced protein 78C	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 7	0.0036	0.0253	0.0469
Brugia malayi	transcriptional regulator, Sir2 family protein	0.0036	0.0253	0.0469
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0157	0.2063	0.2121
Echinococcus multilocularis	discoidin domain containing receptor 2	0.0033	0.0216	0.04
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.002	0.0024	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.002	0.0024	0.0045
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.002	0.0024	0.0045
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Brugia malayi	acetyltransferase, GNAT family protein	0.0381	0.5395	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0024	0.0025
Trypanosoma cruzi	cruzipain precursor, putative	0.003	0.0164	0.0124
Schistosoma mansoni	cathepsin F (C01 family)	0.0021	0.004	0.0074
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Giardia lamblia	Cathepsin B precursor	0.0056	0.0548	0.0841
Onchocerca volvulus		0.003	0.0164	0.0412
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0271	0.3767	1
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Echinococcus multilocularis	cysteine protease	0.003	0.0164	0.0303
Echinococcus multilocularis	discoidin domain containing receptor 2	0.0033	0.0216	0.04
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.003	0.0164	0.0303
Brugia malayi	transcriptional regulator, Sir2 family protein	0.0036	0.0253	0.0469
Toxoplasma gondii	F5/8 type C domain-containing protein	0.0033	0.0216	0.0263
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Brugia malayi	Cathepsin L-like precursor	0.0021	0.004	0.0074
Mycobacterium tuberculosis	Transcriptional regulatory protein	0.0036	0.0253	0.0139
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0271	0.3767	1
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Giardia lamblia	Cathepsin B precursor	0.0056	0.0548	0.0841
Loa Loa (eye worm)	hypothetical protein	0.0021	0.004	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0021	0.004	0.0074
Onchocerca volvulus		0.0269	0.3734	1
Toxoplasma gondii	cathepsin B	0.0056	0.0548	0.1943
Onchocerca volvulus		0.0033	0.0216	0.0552
Plasmodium vivax	NAD-dependent deacetylase, putative	0.0036	0.0253	0.047
Loa Loa (eye worm)	hypothetical protein	0.0265	0.3669	0.6802
Echinococcus multilocularis	cathepsin b	0.0159	0.2089	0.3872
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Loa Loa (eye worm)	hypothetical protein	0.0193	0.2591	0.4803
Loa Loa (eye worm)	transcriptional regulator	0.0036	0.0253	0.0469
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Schistosoma mansoni	discoidin domain receptor	0.0033	0.0216	0.04
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0173	0.2295	0.2265
Loa Loa (eye worm)	transcriptional regulator	0.0036	0.0253	0.0469
Trypanosoma cruzi	cysteine peptidase, putative	0.003	0.0164	0.0124
Brugia malayi	Cathepsin L-like precursor	0.003	0.0164	0.0303
Trypanosoma cruzi	Silent information regulator 2 related protein 1	0.0036	0.0253	0.0214
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Loa Loa (eye worm)	hypothetical protein	0.002	0.0024	0.0045
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 3	0.0036	0.0253	0.0469
Loa Loa (eye worm)	hypothetical protein	0.0271	0.3767	0.6984
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.002	0.0024	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0159	0.2089	0.3872
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0159	0.2089	0.2057
Loa Loa (eye worm)	CBP-B	0.0187	0.2507	0.4647
Loa Loa (eye worm)	transcriptional regulator	0.0036	0.0253	0.0469
Plasmodium falciparum	transcriptional regulatory protein sir2a	0.0036	0.0253	0.0532
Brugia malayi	Steroid receptor seven-up type 2	0.002	0.0024	0.0045
Schistosoma mansoni	chromatin regulatory protein sir2	0.0036	0.0253	0.0469
Entamoeba histolytica	NAD-dependent deacetylase 1, putative	0.0036	0.0253	0.1182
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0021	0.004	0.0074
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0023	0.0065	0.012
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0024	0.0045
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.002	0.0024	0.0045
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0024	0.0025
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Onchocerca volvulus	Cathepsin F homolog	0.003	0.0164	0.0412
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.002	0.0024	0.0045
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0213	0.289	1
Brugia malayi	steroid hormone receptor	0.002	0.0024	0.0045
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0036	0.0253	0.0571
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	0.0671	0.9725	1
Giardia lamblia	Cathepsin B precursor	0.0056	0.0548	0.0841
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0216	0.04
Onchocerca volvulus		0.003	0.0164	0.0412
Trypanosoma cruzi	cysteine peptidase, putative	0.003	0.0164	0.0124
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.003	0.0164	0.0331
Echinococcus multilocularis	discoidin domain containing receptor 2	0.0033	0.0216	0.04
Echinococcus granulosus	cathepsin b	0.0159	0.2089	0.2148
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.003	0.0164	0.0303
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.002	0.0024	0.0045
Plasmodium falciparum	histone acetyltransferase GCN5	0.0142	0.1841	1
Plasmodium vivax	LCCL domain-containing protein	0.0033	0.0216	0.0274
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0216	0.0471
Mycobacterium ulcerans	hypothetical protein	0.0213	0.289	1
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0381	0.5395	1
Echinococcus granulosus	discoidin domain containing receptor 2	0.0033	0.0216	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.003	0.0164	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0019	0.001	0.0018
Trichomonas vaginalis	beta-hexosaminidase B, putative	0.0033	0.0216	0.0471
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.002	0.0024	0.0025
Entamoeba histolytica	acetyltransferase, GNAT family	0.0142	0.1841	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 82.3 nM	Inhibition of c-KIT (unknown origin) using Ser/Thr 6 peptide as substrate incubated for 1 hr prior to substrate addition measured after 2 hrs by FRET assay	ChEMBL.	23521020
IC50 (binding)	= 470 nM	Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 hr by TR-FRET assay	ChEMBL.	23521020
IC50 (binding)	> 1 uM	Inhibition of DDR2 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 hr by TR-FRET assay	ChEMBL.	23521020

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: CHEMBL2336039

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1735498