TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 391.465 | Formula: C21H18FN5S
H donors: 2 H acceptors: 3 LogP: 4 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CSc1nc(c([nH]1)c1ccnc(c1)NCc1ccncc1)c1ccc(cc1)F
InChi: 1S/C21H18FN5S/c1-28-21-26-19(15-2-4-17(22)5-3-15)20(27-21)16-8-11-24-18(12-16)25-13-14-6-9-23-10-7-14/h2-12H,13H2,1H3,(H,24,25)(H,26,27)
InChiKey: ICFASJPUVIHWHD-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	mitogen-activated protein kinase 14	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Brugia malayi	P38 map kinase family protein 2	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania infantum	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania mexicana	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania donovani	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma congolense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Schistosoma japonicum	ko:K04441 p38 MAP kinase, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei gambiense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania braziliensis	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	mitogen-activated protein kinase 14	360 aa	336 aa	33.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	glutamate receptor	0.0064	0.0538	0.1053
Schistosoma mansoni	jumonji domain containing protein	0.0025	0.0078	0.008
Brugia malayi	metabotropic GABA-B receptor subtype 2	0.0026	0.0096	0.0187
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0275	0.0532
Plasmodium vivax	JmjC domain containing protein	0.0028	0.012	0.5162
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0032	0.0161	0.0161
Brugia malayi	metabotropic glutamate receptor type 2	0.0079	0.0718	0.142
Trichomonas vaginalis	conserved hypothetical protein	0.0177	0.1866	0.6648
Brugia malayi	cask-interacting protein 2	0.0025	0.0075	0.0146
Giardia lamblia	Giardia trophozoite antigen GTA-1	0.0025	0.0075	0.5
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0308	0.0533
Loa Loa (eye worm)	toll and interleukin 1 receptor domain-containing protein isoform f	0.0025	0.0075	0.0134
Echinococcus multilocularis	chromobox protein 2	0.0193	0.2052	0.2052
Echinococcus granulosus	polyhomeotic proximal chromatin protein	0.0025	0.0075	0.013
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Echinococcus multilocularis	histone acetyltransferase myst3	0.0042	0.0278	0.0278
Brugia malayi	jmjC domain containing protein	0.0136	0.1385	0.2744
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0269	0.0518
Echinococcus multilocularis	tumor suppressor p53 binding protein 1	0.032	0.3549	0.3549
Echinococcus multilocularis	chromodomain helicase DNA binding protein 4	0.0028	0.012	0.012
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0079	0.0716	0.1238
Schistosoma mansoni	lip-related protein (liprin) alpha	0.0025	0.0075	0.0078
Echinococcus granulosus	histone acetyltransferase MYST2	0.0094	0.0887	0.1535
Echinococcus multilocularis	sphingomyelin synthase protein 1	0.0025	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0079	0.0716	0.0716
Brugia malayi	Bromodomain containing protein	0.0096	0.0908	0.1799
Echinococcus granulosus	mitogen activated protein kinase 14	0.0152	0.1572	0.272
Echinococcus multilocularis	Sterile alpha motif type	0.0025	0.0075	0.0075
Echinococcus granulosus	GPCR family 3 C terminal	0.0026	0.0096	0.0165
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0042	0.028	0.9491
Schistosoma mansoni	hypothetical protein	0.0186	0.1971	0.2043
Onchocerca volvulus		0.0025	0.0075	0.0146
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0055	0.0428	0.0846
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0114	0.1122	0.194
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0025	0.0078	0.0134
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	0.0026	0.0096	0.0187
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0043	0.0293	0.0304
Loa Loa (eye worm)	hypothetical protein	0.002	0.0018	0.002
Echinococcus multilocularis	neuropeptide receptor A26	0.045	0.5073	0.5073
Onchocerca volvulus		0.0295	0.3255	0.6454
Onchocerca volvulus		0.0043	0.0293	0.0579
Brugia malayi	AIDA-1b	0.0025	0.0075	0.0146
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0308	0.0319
Onchocerca volvulus	Tankyrase homolog	0.0025	0.0075	0.0146
Echinococcus multilocularis	liprin alpha 2	0.0025	0.0075	0.0075
Loa Loa (eye worm)	metabotropic GABA-B receptor subtype 2	0.0042	0.0275	0.0532
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0055	0.0428	0.0846
Onchocerca volvulus	Poor gastrulation protein homolog	0.0026	0.0096	0.0187
Echinococcus granulosus	mitogen activated protein kinase 11	0.0152	0.1572	0.272
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0718	0.141
Schistosoma mansoni	lar interacting protein (lip)-related protein	0.0025	0.0075	0.0078
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0223	0.2407	0.4765
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.098
Brugia malayi	hypothetical protein	0.0025	0.0075	0.0146
Onchocerca volvulus		0.0025	0.0075	0.0146
Loa Loa (eye worm)	hypothetical protein	0.005	0.0376	0.0732
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0114	0.1122	0.1122
Echinococcus granulosus	zinc finger protein	0.0036	0.021	0.0364
Brugia malayi	Metabotropic glutamate receptor precursor.	0.0042	0.0275	0.0543
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.1572	1
Schistosoma mansoni	hypothetical protein	0.0026	0.0096	0.0099
Onchocerca volvulus		0.0025	0.0075	0.0146
Brugia malayi	Liprin-alpha 2	0.0025	0.0075	0.0146
Brugia malayi	latrophilin 2 splice variant baaae	0.0037	0.0225	0.0443
Brugia malayi	CHD4 protein	0.0028	0.012	0.0235
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0377	0.4211	0.4211
Brugia malayi	PHD-finger family protein	0.0042	0.0277	0.0547
Schistosoma mansoni	DNAj-like protein	0.0025	0.0075	0.0078
Brugia malayi	sterile alpha and TIR motif containing protein 1 isoform a	0.0025	0.0075	0.0146
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0039	0.0238	0.0411
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0308	0.0319
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	0.0152	0.1572	1
Brugia malayi	coiled-coil like protein 1	0.0025	0.0075	0.0146
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0161	0.0167
Echinococcus granulosus	SAM and MBT domain containing protein	0.0377	0.4211	0.7285
Echinococcus granulosus	liprin alpha 2	0.0025	0.0075	0.013
Echinococcus granulosus	sterile alpha and tir motif containing protein	0.0025	0.0075	0.013
Echinococcus granulosus	histone lysine methyltransferase setb	0.005	0.0376	0.0651
Brugia malayi	Bromodomain containing protein	0.0041	0.0268	0.0528
Loa Loa (eye worm)	hypothetical protein	0.0094	0.0887	0.1747
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0308	0.0308
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0377	0.4211	0.4365
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0308	0.0533
Schistosoma mansoni	Protein aveugle	0.0025	0.0075	0.0078
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0055	0.0428	0.0835
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Plasmodium vivax	SET domain protein, putative	0.0032	0.0161	1
Toxoplasma gondii	PLU-1 family protein	0.0043	0.029	1
Echinococcus granulosus	tumor suppressor p53 binding protein 1	0.032	0.3549	0.614
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0308	0.0608
Brugia malayi	Pre-SET motif family protein	0.0223	0.2407	0.4772
Loa Loa (eye worm)	PHD-finger family protein	0.0022	0.0045	0.0074
Echinococcus granulosus	geminin	0.0186	0.1971	0.3409
Brugia malayi	Receptor family ligand binding region containing protein	0.0042	0.0275	0.0543
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0094	0.0887	0.092
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Schistosoma mansoni	spingomyelin synthetase-related	0.0025	0.0075	0.0078
Echinococcus granulosus	Sterile alpha motif SAM	0.0025	0.0075	0.013
Echinococcus multilocularis	sterile alpha and tir motif containing protein	0.0025	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0676	0.1327
Echinococcus granulosus	pdz domain containing protein	0.0025	0.0075	0.013
Schistosoma mansoni	hypothetical protein	0.0025	0.0075	0.0078
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Echinococcus granulosus	histone acetyltransferase myst3	0.0042	0.0278	0.048
Onchocerca volvulus	Metabotropic glutamate receptor homolog	0.0026	0.0096	0.0187
Brugia malayi	P38 map kinase family protein 2	0.0152	0.1572	0.3115
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.051	0.578	0.578
Loa Loa (eye worm)	hypothetical protein	0.0182	0.1925	0.3807
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0308	0.0597
Trichomonas vaginalis	set domain proteins, putative	0.0254	0.2769	1
Schistosoma mansoni	hypothetical protein	0.0186	0.1971	0.2043
Brugia malayi	Sphingomyelin synthase-related 1	0.0025	0.0075	0.0146
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.005	0.0376	0.039
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0094	0.0887	0.1757
Echinococcus multilocularis	pdz domain containing protein	0.0025	0.0075	0.0075
Loa Loa (eye worm)	glutamate receptor	0.0042	0.0275	0.0532
Echinococcus granulosus	lysine specific demethylase 5A	0.0093	0.0879	0.1521
Echinococcus granulosus	sphingomyelin synthase protein 1	0.0025	0.0075	0.013
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.005	0.0376	0.039
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.1572	0.1572
Echinococcus multilocularis	neuropeptide s receptor	0.045	0.5073	0.5073
Brugia malayi	Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog	0.0182	0.1925	0.3815
Echinococcus multilocularis	Sterile alpha motif SAM	0.0025	0.0075	0.0075
Schistosoma mansoni	hypothetical protein	0.032	0.3549	0.3678
Brugia malayi	mbt repeat family protein	0.0447	0.5043	1
Loa Loa (eye worm)	receptor family ligand binding region containing protein	0.0042	0.0275	0.0532
Schistosoma mansoni	hypothetical protein	0.0037	0.0225	0.0233
Loa Loa (eye worm)	CHromoDomain protein family member	0.0028	0.012	0.0223
Brugia malayi	hypothetical protein	0.0025	0.0075	0.0146
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0039	0.0248	0.0248
Schistosoma mansoni	hypothetical protein	0.0022	0.0045	0.0047
Echinococcus granulosus	neuropeptide s receptor	0.045	0.5073	0.8776
Schistosoma mansoni	bromodomain containing protein	0.002	0.0018	0.0018
Brugia malayi	jmjC domain containing protein	0.0025	0.0078	0.0151
Loa Loa (eye worm)	MBCTL1	0.0094	0.0887	0.1747
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0447	0.5043	1
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.051	0.578	1
Schistosoma mansoni	Protein aveugle	0.0025	0.0075	0.0078
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0039	0.0248	0.0257
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Toxoplasma gondii	histone lysine demethylase JMJC1/KDM5D/JARID1D	0.0032	0.0157	0.3694
Schistosoma mansoni	hypothetical protein	0.0025	0.0075	0.0078
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0025	0.0078	0.0078
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0308	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0134
Onchocerca volvulus		0.0254	0.2769	0.549
Loa Loa (eye worm)	jmjC domain-containing protein	0.0136	0.1385	0.2735
Onchocerca volvulus		0.0025	0.0075	0.0146
Onchocerca volvulus		0.0025	0.0075	0.0146
Loa Loa (eye worm)	mbt repeat family protein	0.0271	0.2965	0.5874
Onchocerca volvulus		0.0025	0.0075	0.0146
Schistosoma mansoni	chromobox protein	0.0193	0.2052	0.2126
Loa Loa (eye worm)	hypothetical protein	0.0447	0.5043	1
Echinococcus granulosus	chromodomain helicase DNA binding protein 4	0.0028	0.012	0.0208
Schistosoma mansoni	polyhomeotic	0.0025	0.0075	0.0078
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	0.0152	0.1572	0.3107
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0428	0.0835
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0028	0.012	0.5
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0308	0.0308
Brugia malayi	Shank2E	0.0025	0.0075	0.0146
Schistosoma mansoni	sex comb on midleg homolog	0.026	0.2841	0.2945
Schistosoma mansoni	sex comb on midleg homolog	0.026	0.2841	0.2945
Echinococcus multilocularis	polycomb protein SCMH1	0.026	0.2841	0.2841
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	0.0152	0.1572	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0096	0.0175
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.1572	1
Echinococcus granulosus	metabotropic glutamate receptor 5	0.0079	0.0718	0.1241
Echinococcus multilocularis	polyhomeotic proximal chromatin protein	0.0025	0.0075	0.0075
Schistosoma mansoni	hypothetical protein	0.0839	0.9648	1
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0094	0.0887	0.1535
Echinococcus multilocularis	polyhomeotic protein 2	0.0025	0.0075	0.0075
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.1572	0.1572
Brugia malayi	mbt repeat family protein	0.0271	0.2965	0.5879
Brugia malayi	bicaudal-C	0.0025	0.0075	0.0146
Echinococcus granulosus	polycomb protein SCMH1	0.026	0.2841	0.4915
Schistosoma mansoni	metabotropic glutamate receptor	0.0079	0.0718	0.0744
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.1572	0.1572
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0093	0.0879	0.0911
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0094	0.0887	0.0887
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0093	0.0879	0.0911
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0094	0.0887	0.0887
Schistosoma mansoni	SET domain protein	0.0018	0.0002	0.0002
Schistosoma mansoni	bromodomain containing protein	0.0083	0.0761	0.0789
Schistosoma mansoni	zinc finger protein	0.0036	0.021	0.0218
Echinococcus multilocularis	GPCR, family 3, C terminal	0.0026	0.0096	0.0096
Echinococcus granulosus	liprin alpha 2	0.0025	0.0075	0.013
Echinococcus multilocularis	liprin alpha 2	0.0025	0.0075	0.0075
Echinococcus granulosus	neuropeptide receptor A26	0.045	0.5073	0.8776
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0028	0.012	0.0124
Brugia malayi	Pre-SET motif family protein	0.0032	0.0161	0.0317
Echinococcus multilocularis	geminin	0.0186	0.1971	0.1971
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0225	0.0431
Schistosoma mansoni	phd finger protein	0.0042	0.0278	0.0288
Loa Loa (eye worm)	AIDA-1b	0.0025	0.0075	0.0134
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0147	0.0255
Echinococcus multilocularis	zinc finger protein	0.0036	0.021	0.021
Echinococcus granulosus	Sterile alpha motif type	0.0025	0.0075	0.013
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.0079	0.0718	0.0718
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.0064	0.0538	0.0557
Echinococcus multilocularis	lysine specific demethylase 5A	0.0076	0.0677	0.0677
Loa Loa (eye worm)	tnks protein	0.0025	0.0075	0.0134
Echinococcus granulosus	polyhomeotic protein 2	0.0025	0.0075	0.013
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0298	0.0577
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.1572	0.1572
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.005	0.0376	0.0376
Echinococcus granulosus	fetal alzheimer antigen falz	0.0039	0.0248	0.0428
Giardia lamblia	Kinesin-13	0.0025	0.0075	0.5
Echinococcus granulosus	chromobox protein 2	0.0193	0.2052	0.3549
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0039	0.0238	0.0238

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.119 uM	Inhibition of p38alpha	ChEMBL.	18578517
IC50 (functional)	= 6.22 uM	Inhibition of TNFalpha release in human whole blood	ChEMBL.	18578517

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	18578517

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: CHEMBL506320

Bibliographic References

1 literature reference was collected for this gene.

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

Detailed information for compound 1176700