TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 400.272 | Formula: C18H18BrN5O
H donors: 0 H acceptors: 3 LogP: 3.3 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Brc1cccc(c1)OC1CCN(CC1)c1ccc(nn1)n1cncc1
InChi: 1S/C18H18BrN5O/c19-14-2-1-3-16(12-14)25-15-6-9-23(10-7-15)17-4-5-18(22-21-17)24-11-8-20-13-24/h1-5,8,11-13,15H,6-7,9-10H2
InChiKey: JRDIINKNGKEKOH-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
Rattus norvegicus	Acyl-CoA desaturase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma brucei	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Loa Loa (eye worm)	acyl-CoA desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania major	fatty-acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Trypanosoma cruzi	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Plasmodium falciparum	stearoyl-CoA desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Onchocerca volvulus		Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania braziliensis	stearic acid desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Trypanosoma congolense	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania donovani	fatty-acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Candida albicans	one of two potential fatty acid desaturase genes similar to S. cerevisiae OLE1 (YGL055W) delta-9-fatty acid desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Trypanosoma brucei gambiense	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Plasmodium yoelii	delta-9 fatty acid desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Trypanosoma cruzi	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania mexicana	fatty-acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Brugia malayi	acyl-CoA desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania infantum	fatty-acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Candida albicans	one of two potential fatty acid desaturase genes similar to S. cerevisiae OLE1 (YGL055W) delta-9-fatty acid desaturase	Get druggable targets OG5_126939	All targets in OG5_126939
Plasmodium knowlesi	stearoyl-CoA desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania braziliensis	fatty-acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania donovani	stearic acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Onchocerca volvulus		Get druggable targets OG5_126939	All targets in OG5_126939
Plasmodium berghei	stearoyl-CoA desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania mexicana	stearic acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania major	stearic acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Trypanosoma cruzi	fatty acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Neospora caninum	fatty acyl-CoA desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939
Leishmania infantum	stearic acid desaturase, putative	Get druggable targets OG5_126939	All targets in OG5_126939

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Candida albicans	one of two potential fatty acid desaturase genes similar to S. cerevisiae OLE1 (YGL055W) delta-9 fatty acid desaturase	Acyl-CoA desaturase 1	358 aa	317 aa	27.1 %
Candida albicans	one of two potential fatty acid desaturase genes similar to S. cerevisiae OLE1 (YGL055W) delta-9 fatty acid desaturase	Acyl-CoA desaturase 1	358 aa	317 aa	27.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.105	0.1702
Schistosoma mansoni	transient receptor potential channel	0.0063	0.1842	0.3101
Brugia malayi	Delta5 fatty acid desaturase	0.0018	0.0087	0.0097
Brugia malayi	RNA recognition motif domain containing protein	0.0064	0.187	0.2074
Brugia malayi	TAR-binding protein	0.0064	0.187	0.2074
Loa Loa (eye worm)	TAR-binding protein	0.0064	0.187	0.2072
Echinococcus multilocularis	cyclin dependent kinase	0.0042	0.1004	0.1619
Giardia lamblia	Kinase, CMGC CDK	0.0042	0.1004	0.5
Schistosoma mansoni	hypothetical protein	0.0164	0.5746	1
Plasmodium vivax	protein kinase Crk2	0.0042	0.1004	0.3942
Trypanosoma cruzi	cdc2-related kinase 1	0.0042	0.1004	0.3469
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0645	0.0714
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.187	0.3151
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0249	0.902	1
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0042	0.1004	0.1619
Schistosoma mansoni	transient receptor potential channel	0.0063	0.1842	0.3101
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0083	0.2615	0.9569
Schistosoma mansoni	serine/threonine protein kinase	0.0042	0.1004	0.1619
Onchocerca volvulus		0.0086	0.2729	1
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0075	0.2277	1
Trypanosoma brucei	fatty acid desaturase, putative	0.0086	0.2729	1
Echinococcus multilocularis	short transient receptor potential channel 6	0.0063	0.1842	0.3101
Echinococcus granulosus	short transient receptor potential channel 6	0.0063	0.1842	0.3101
Plasmodium falciparum	stearoyl-CoA desaturase	0.0068	0.2031	1
Leishmania major	fatty-acid desaturase, putative	0.0086	0.2729	1
Trypanosoma brucei	cdc2-related kinase 1	0.0042	0.1004	0.3469
Onchocerca volvulus		0.0086	0.2729	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0639	0.0975
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative	0.0068	0.2031	1
Loa Loa (eye worm)	hypothetical protein	0.007	0.209	0.2316
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0043	0.105	0.0971
Brugia malayi	intermediate filament protein	0.0029	0.0531	0.0589
Echinococcus granulosus	intermediate filament protein	0.0029	0.0531	0.0784
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1208	0.1981
Onchocerca volvulus		0.0043	0.105	0.3646
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0639	0.0708
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0083	0.2615	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.105	0.1702
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.105	0.3646
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Mycobacterium tuberculosis	Probable lipase LipD	0.0043	0.105	0.0971
Loa Loa (eye worm)	inositol-1	0.0083	0.2615	0.2898
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0047	0.1208	0.134
Echinococcus granulosus	short transient receptor potential channel 6	0.0063	0.1842	0.3101
Schistosoma mansoni	hypothetical protein	0.0038	0.0872	0.1386
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.105	0.3646
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0042	0.1004	0.1111
Leishmania major	hypothetical protein, conserved	0.0024	0.0335	0.0938
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0042	0.1004	0.1111
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0102	0.3339	0.3703
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.105	0.029
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0036	0.0769	0.1204
Echinococcus multilocularis	transient receptor potential ion channel A	0.0093	0.2974	0.5102
Brugia malayi	follicle stimulating hormone receptor	0.0249	0.902	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0102	0.3339	0.3702
Brugia malayi	RNA binding protein	0.0064	0.187	0.2074
Brugia malayi	Fatty acid desaturase family protein	0.0018	0.0087	0.0097
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0639	0.0975
Echinococcus granulosus	geminin	0.0164	0.5746	1
Loa Loa (eye worm)	fatty acid desaturase	0.0018	0.0087	0.0096
Brugia malayi	cell division control protein 2 homolog	0.0042	0.1004	0.1113
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.105	0.1165
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0064	0.187	0.2072
Brugia malayi	hypothetical protein	0.0038	0.0872	0.0966
Mycobacterium tuberculosis	Conserved protein	0.0043	0.105	0.0971
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0639	0.0709
Brugia malayi	Inositol-1	0.0083	0.2615	0.2899
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0083	0.2615	0.9569
Trichomonas vaginalis	inositol monophosphatase, putative	0.0083	0.2615	1
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Schistosoma mansoni	hypothetical protein	0.0164	0.5746	1
Brugia malayi	latrophilin 2 splice variant baaae	0.007	0.209	0.2317
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0083	0.2615	0.9569
Schistosoma mansoni	hypothetical protein	0.007	0.209	0.3539
Echinococcus multilocularis	geminin	0.0164	0.5746	1
Mycobacterium tuberculosis	Probable hydrolase	0.0043	0.105	0.0971
Echinococcus multilocularis	lamin dm0	0.0029	0.0531	0.0784
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.187	0.3151
Loa Loa (eye worm)	beta-lactamase	0.0043	0.105	0.1163
Brugia malayi	hypothetical protein	0.0024	0.0335	0.0372
Plasmodium falciparum	protein kinase 5	0.0042	0.1004	0.3942
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0102	0.3339	0.3703
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0083	0.2615	1
Trypanosoma cruzi	fatty acid desaturase, putative	0.0086	0.2729	1
Echinococcus granulosus	TRP transient receptor potential channel	0.0036	0.0769	0.1204
Leishmania major	stearic acid desaturase, putative	0.0086	0.2729	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0986	0.1092
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Echinococcus multilocularis	cyclin dependent kinase 1	0.0042	0.1004	0.1619
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.1208	0.1981
Brugia malayi	acyl-CoA desaturase	0.0068	0.2031	0.2252
Brugia malayi	cytoplasmic intermediate filament protein	0.0016	0.0001	0.0001
Echinococcus granulosus	lamin	0.0029	0.0531	0.0784
Brugia malayi	beta-lactamase family protein	0.0043	0.105	0.1165
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.105	0.1702
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0639	0.0975
Echinococcus multilocularis	musashi	0.0029	0.0531	0.0784
Schistosoma mansoni	transcription factor LCR-F1	0.0038	0.0872	0.1386
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0038	0.0872	0.1386
Trypanosoma cruzi	fatty acid desaturase, putative	0.0068	0.2031	0.7358
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0083	0.2615	0.5
Schistosoma mansoni	intermediate filament proteins	0.0029	0.0531	0.0784
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.105	0.029
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0335	0.037
Echinococcus granulosus	lamin dm0	0.0029	0.0531	0.0784
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0029	0.0531	0.0588
Schistosoma mansoni	hypothetical protein	0.0032	0.0639	0.0975
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0042	0.1004	0.1111
Echinococcus multilocularis	transient receptor potential gamma protein	0.0096	0.3098	0.532
Schistosoma mansoni	hypothetical protein	0.0032	0.0639	0.0975
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0075	0.2277	0.2209
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.105	0.029
Toxoplasma gondii	ABC1 family protein	0.0043	0.105	0.381
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Brugia malayi	Protein kinase domain containing protein	0.0042	0.1004	0.1113
Mycobacterium ulcerans	beta-lactamase	0.0043	0.105	0.381
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0083	0.2615	1
Trypanosoma cruzi	cdc2-related kinase 3	0.0042	0.1004	0.3469
Brugia malayi	beta-lactamase	0.0043	0.105	0.1165
Loa Loa (eye worm)	FAT-3 protein	0.0018	0.0087	0.0096
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.187	0.3151
Leishmania major	hypothetical protein, conserved	0.0043	0.105	0.3646
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1208	0.1981
Entamoeba histolytica	cell division protein kinase 2, putative	0.0042	0.1004	0.0757
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0083	0.2615	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0769	0.0851
Mycobacterium ulcerans	lipase LipD	0.0043	0.105	0.381
Loa Loa (eye worm)	hypothetical protein	0.0029	0.051	0.0565
Echinococcus multilocularis	lamin	0.0029	0.0531	0.0784
Loa Loa (eye worm)	hypothetical protein	0.0043	0.105	0.1163
Schistosoma mansoni	transient receptor potential channel 4	0.0096	0.3098	0.532
Echinococcus multilocularis	cyclin dependent kinase 5	0.0042	0.1004	0.1619
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.105	0.4218
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0042	0.1004	0.3625
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1208	0.1981
Entamoeba histolytica	cell division protein kinase 2, putative	0.0042	0.1004	0.0757
Onchocerca volvulus		0.0029	0.0531	0.168
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0335	0.0938
Schistosoma mansoni	hypothetical protein	0.0032	0.0639	0.0975
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.187	0.3151
Schistosoma mansoni	serine/threonine protein kinase	0.0042	0.1004	0.1619
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.105	0.1163
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0531	0.0588
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0087	0.0096
Schistosoma mansoni	hypothetical protein	0.0032	0.0639	0.0975
Schistosoma mansoni	lamin	0.0029	0.0531	0.0784
Onchocerca volvulus		0.0043	0.105	0.3646
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0639	0.0975
Loa Loa (eye worm)	hypothetical protein	0.0096	0.3098	0.3434
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0043	0.105	0.0971
Onchocerca volvulus		0.0043	0.105	0.3646
Echinococcus multilocularis	tar DNA binding protein	0.0064	0.187	0.3151
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.105	0.1702
Schistosoma mansoni	inositol monophosphatase	0.0083	0.2615	0.4467
Loa Loa (eye worm)	fatty acid desaturase	0.0018	0.0087	0.0096
Schistosoma mansoni	inositol monophosphatase	0.0083	0.2615	0.4467
Trichomonas vaginalis	esterase, putative	0.0043	0.105	0.029
Echinococcus granulosus	transient receptor potential gamma protein	0.0096	0.3098	0.532
Mycobacterium tuberculosis	Conserved protein	0.0043	0.105	0.0971
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.105	0.381
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0042	0.1004	0.3469
Schistosoma mansoni	transient receptor potential channel	0.0096	0.3098	0.532
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.105	0.381
Trypanosoma cruzi	fatty acid desaturase, putative	0.0068	0.2031	0.7358
Mycobacterium ulcerans	hypothetical protein	0.0043	0.105	0.381
Brugia malayi	Intermediate filament tail domain containing protein	0.0029	0.0531	0.0589
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0083	0.2615	0.9569
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0639	0.0709
Toxoplasma gondii	LsmAD domain-containing protein	0.0024	0.0335	0.098
Echinococcus granulosus	tar DNA binding protein	0.0064	0.187	0.3151
Trypanosoma cruzi	cdc2-related kinase 3	0.0042	0.1004	0.3469
Echinococcus granulosus	GPCR family 2	0.0032	0.0639	0.0975
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0047	0.1208	0.1339
Echinococcus multilocularis	short transient receptor potential channel 6	0.0063	0.1842	0.3101
Echinococcus multilocularis	cyclin dependent kinase 1	0.0042	0.1004	0.1619
Trypanosoma cruzi	cdc2-related kinase 1	0.0042	0.1004	0.3469
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.105	0.3646
Onchocerca volvulus		0.0029	0.0531	0.168
Echinococcus granulosus	cyclin dependent kinase	0.0042	0.1004	0.1619
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.1208	0.1981
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.105	0.029
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0639	0.0975
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0038	0.0872	0.1386
Echinococcus granulosus	inositol monophosphatase 1	0.0083	0.2615	0.4467
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.105	0.029
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.1208	0.1981
Trypanosoma brucei	cdc2-related kinase 3	0.0042	0.1004	0.3469
Brugia malayi	Transient-receptor-potential like protein	0.0036	0.0769	0.0852
Mycobacterium tuberculosis	Probable lipase LipE	0.0043	0.105	0.0971
Loa Loa (eye worm)	intermediate filament protein	0.0029	0.0531	0.0588
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.1208	0.1981
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0083	0.2615	1
Echinococcus granulosus	cyclin dependent kinase 1	0.0042	0.1004	0.1619
Mycobacterium tuberculosis	Probable esterase LipL	0.0043	0.105	0.0971
Giardia lamblia	Kinase, CMGC CDK	0.0042	0.1004	0.5
Echinococcus multilocularis	inositol monophosphatase 1	0.0083	0.2615	0.4467
Brugia malayi	beta-lactamase family protein	0.0043	0.105	0.1165
Echinococcus granulosus	cyclin dependent kinase 5	0.0042	0.1004	0.1619
Loa Loa (eye worm)	acyl-CoA desaturase	0.0068	0.2031	0.2251
Schistosoma mansoni	lamin	0.0029	0.0531	0.0784
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.187	0.3151
Loa Loa (eye worm)	hypothetical protein	0.006	0.1719	0.1904
Trypanosoma brucei	PAB1-binding protein , putative	0.0024	0.0335	0.0938
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0335	0.0938
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0043	0.105	0.0971
Echinococcus granulosus	transient receptor potential ion channel A	0.0093	0.2974	0.5102
Loa Loa (eye worm)	hypothetical protein	0.0102	0.3339	0.3702
Mycobacterium tuberculosis	Conserved protein	0.0043	0.105	0.0971
Brugia malayi	Fatty acid desaturase family protein	0.0018	0.0087	0.0097
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0042	0.1004	0.3469
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0639	0.0708
Loa Loa (eye worm)	RNA binding protein	0.0064	0.187	0.2072

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 23 nM	Inhibition of SCD1 in rat liver microsomes	ChEMBL.	20004097

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.

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External resources for this compound

ChEMBL: CHEMBL607822

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1111032