TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 389.374 | Formula: C19H18F3N5O
H donors: 0 H acceptors: 3 LogP: 3.49 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: FC(c1cccc(c1)OC1CCN(CC1)c1ccc(nn1)n1cncc1)(F)F
InChi: 1S/C19H18F3N5O/c20-19(21,22)14-2-1-3-16(12-14)28-15-6-9-26(10-7-15)17-4-5-18(25-24-17)27-11-8-23-13-27/h1-5,8,11-13,15H,6-7,9-10H2
InChiKey: KRQZTSVISKCFKK-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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

Clustering layers

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

Synonyms

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
Loa Loa (eye worm)	acyl-CoA desaturase	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
Leishmania major	stearic 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
Leishmania braziliensis	fatty-acid desaturase, putative	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
Trypanosoma brucei	fatty acid desaturase, putative	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
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
Trypanosoma cruzi	fatty acid desaturase, putative	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
Leishmania major	fatty-acid desaturase, putative	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
Trypanosoma cruzi	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 vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty 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
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 falciparum	stearoyl-CoA desaturase	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
Leishmania infantum	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
Neospora caninum	fatty acyl-CoA 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

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
Onchocerca volvulus		0.0156	0.1184	0.1184
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.002	0.0022
Brugia malayi	MH2 domain containing protein	0.0027	0.0076	0.0087
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.0657	0.1128
Brugia malayi	hypothetical protein	0.0312	0.252	0.2875
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.002	0.0022
Echinococcus granulosus	PHD finger protein rhinoceros	0.003	0.0101	0.0112
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0183	0.1412	0.1571
Schistosoma mansoni	bromodomain containing protein	0.0133	0.0987	0.1696
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Loa Loa (eye worm)	PHD-finger family protein	0.003	0.0101	0.0115
Brugia malayi	PHD-finger family protein	0.003	0.0101	0.0115
Onchocerca volvulus		0.0108	0.0773	0.0773
Echinococcus granulosus	peregrin	0.0035	0.0144	0.016
Trypanosoma brucei	hypothetical protein, conserved	0.0108	0.0773	1
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.002	0.0252
Brugia malayi	jmjC domain containing protein	0.004	0.0189	0.0216
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.104	0.8767	1
Loa Loa (eye worm)	hypothetical protein	0.0185	0.1433	0.1634
Trypanosoma cruzi	target of rapamycin kinase 3	0.0036	0.0156	0.202
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0037
Brugia malayi	beta-lactamase family protein	0.0108	0.0773	0.0882
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0131	0.0149
Schistosoma mansoni	hypothetical protein	0.0183	0.1412	0.2425
Plasmodium falciparum	stearoyl-CoA desaturase	0.0068	0.043	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0046	0.0236	0.3048
Trypanosoma brucei	ISWI complex protein	0.0032	0.0122	0.1572
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0108	0.0773	0.086
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0065	0.0403	0.0459
Mycobacterium leprae	Probable lipase LipE	0.0108	0.0773	0.5
Brugia malayi	acyl-CoA desaturase	0.0068	0.043	0.0491
Brugia malayi	MH2 domain containing protein	0.006	0.0361	0.0412
Loa Loa (eye worm)	MH1 domain-containing protein	0.006	0.0361	0.0412
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.002	0.0252
Schistosoma mansoni	hypothetical protein	0.014	0.1049	0.1802
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0107	0.0088
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.006	0.0361	0.0402
Echinococcus multilocularis	mothers against decapentaplegic 2	0.0027	0.0076	0.0085
Brugia malayi	Bromodomain containing protein	0.0081	0.0537	0.0612
Echinococcus multilocularis	tar DNA binding protein	0.0326	0.2639	0.2936
Schistosoma mansoni	Smad4	0.006	0.0361	0.062
Trypanosoma cruzi	hypothetical protein, conserved	0.0108	0.0773	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Trypanosoma cruzi	fatty acid desaturase, putative	0.0068	0.043	0.5567
Trichomonas vaginalis	penicillin-binding protein, putative	0.0108	0.0773	0.0755
Echinococcus multilocularis	mothers against decapentaplegic 6	0.0027	0.0076	0.0085
Echinococcus multilocularis	mothers against decapentaplegic 5	0.006	0.0361	0.0402
Echinococcus multilocularis	zinc finger protein	0.0041	0.0199	0.0221
Echinococcus granulosus	tar DNA binding protein	0.0326	0.2639	0.2936
Loa Loa (eye worm)	MH2 domain-containing protein	0.0883	0.7415	0.8457
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0149	0.1125	0.1932
Toxoplasma gondii	PHD-finger domain-containing protein	0.003	0.0101	0.0898
Echinococcus multilocularis	Smad4	0.006	0.0361	0.0402
Loa Loa (eye worm)	MH2 domain-containing protein	0.0027	0.0076	0.0087
Brugia malayi	Bromodomain containing protein	0.0158	0.1199	0.1367
Brugia malayi	Latrophilin receptor protein 2	0.0065	0.0403	0.0459
Loa Loa (eye worm)	PHD-finger family protein	0.0043	0.0218	0.0248
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.002	0.0252
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0065	0.0403	0.0448
Leishmania major	DNA polymerase eta, putative	0.002	0.002	0.0252
Loa Loa (eye worm)	nuclear factor I	0.0033	0.0131	0.0149
Mycobacterium tuberculosis	Probable hydrolase	0.0108	0.0773	0.1339
Toxoplasma gondii	ABC1 family protein	0.0108	0.0773	0.6871
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0829	0.6955	0.7738
Brugia malayi	MH1 domain containing protein	0.006	0.0361	0.0412
Echinococcus multilocularis	jumonji domain containing protein	0.0041	0.0201	0.0224
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0149	0.1125	0.1252
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.2639	0.4532
Brugia malayi	mothers against decapentaplegic homolog 3	0.0027	0.0076	0.0087
Echinococcus granulosus	TGF beta signal transducer SmadC	0.006	0.0361	0.0402
Echinococcus multilocularis	dna polymerase kappa	0.002	0.002	0.0022
Schistosoma mansoni	hypothetical protein	0.0043	0.0218	0.0374
Giardia lamblia	PHD finger protein 15	0.003	0.0101	0.3772
Schistosoma mansoni	DNA polymerase eta	0.002	0.002	0.0034
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0183	0.1412	0.1571
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0098	0.0683	0.0759
Loa Loa (eye worm)	hypothetical protein	0.0156	0.1184	0.135
Schistosoma mansoni	jumonji/arid domain-containing protein	0.004	0.0189	0.0325
Loa Loa (eye worm)	MH2 domain-containing protein	0.006	0.0361	0.0412
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0037
Leishmania major	hypothetical protein, conserved	0.0032	0.0122	0.1572
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0108	0.0773	0.1339
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0108	0.0773	0.1339
Loa Loa (eye worm)	MH1 domain-containing protein	0.0027	0.0076	0.0087
Loa Loa (eye worm)	hypothetical protein	0.014	0.1049	0.1197
Leishmania major	stearic acid desaturase, putative	0.0086	0.0585	0.7566
Loa Loa (eye worm)	RNA binding protein	0.0326	0.2639	0.301
Brugia malayi	PHD-finger family protein	0.0052	0.0295	0.0336
Plasmodium falciparum	phd finger protein, putative	0.003	0.0101	0.079
Brugia malayi	MH1 domain containing protein	0.006	0.0361	0.0412
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0036	0.0156	0.202
Onchocerca volvulus	Alhambra homolog	0.003	0.0101	0.0101
Echinococcus granulosus	dna polymerase kappa	0.002	0.002	0.0022
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0205	0.1606	0.1832
Schistosoma mansoni	smad1 5 8 and	0.006	0.0361	0.062
Brugia malayi	beta-lactamase	0.0108	0.0773	0.0882
Brugia malayi	hypothetical protein	0.0027	0.0073	0.0083
Brugia malayi	MH1 domain containing protein	0.0033	0.0131	0.0149
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0076	0.0494	0.055
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0073	0.0647
Leishmania major	fatty-acid desaturase, putative	0.0086	0.0585	0.7566
Mycobacterium ulcerans	hypothetical protein	0.0108	0.0773	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0284	0.0324
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0326	0.2639	0.301
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.002	0.0034
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Trichomonas vaginalis	set domain proteins, putative	0.1184	1	1
Schistosoma mansoni	hypothetical protein	0.0032	0.0122	0.0209
Brugia malayi	jmjC domain containing protein	0.0098	0.0683	0.0779
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0046	0.0236	0.3048
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.0236	0.0217
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.2639	0.4532
Schistosoma mansoni	Smad4	0.0027	0.0076	0.013
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0205	0.1606	0.1832
Trypanosoma cruzi	fatty acid desaturase, putative	0.0086	0.0585	0.7566
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0095	0.0657	0.0731
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0108	0.0773	0.1339
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0076	0.0057
Echinococcus multilocularis	dna polymerase eta	0.002	0.002	0.0022
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Echinococcus granulosus	lysine specific demethylase 5A	0.004	0.0189	0.0211
Schistosoma mansoni	smad	0.0027	0.0076	0.013
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.002	0.0252
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Trichomonas vaginalis	D-aminoacylase, putative	0.0108	0.0773	0.0755
Mycobacterium ulcerans	lipase LipD	0.0108	0.0773	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0062	0.0373	0.0426
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0403	0.0459
Echinococcus multilocularis	PHD finger protein rhinoceros	0.003	0.0101	0.0112
Onchocerca volvulus		0.0312	0.252	0.252
Schistosoma mansoni	hypothetical protein	0.0697	0.5823	1
Echinococcus granulosus	GPCR family 2	0.0065	0.0403	0.0448
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0046	0.0236	0.3048
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0036	0.0156	0.202
Schistosoma mansoni	hypothetical protein	0.0065	0.0403	0.0692
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.2639	0.4532
Schistosoma mansoni	cellular tumor antigen P53	0.0156	0.1184	0.2033
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0046	0.0236	0.3048
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0036	0.0153	0.0263
Loa Loa (eye worm)	transcription factor SMAD2	0.0883	0.7415	0.8457
Trichomonas vaginalis	D-aminoacylase, putative	0.0108	0.0773	0.0755
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.0236	0.0217
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0076	0.0494	0.055
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0047	0.0252	0.0281
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.002	0.0034
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0691	0.5772	1
Brugia malayi	Smad1	0.006	0.0361	0.0412
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0073	0.0083
Loa Loa (eye worm)	Smad1	0.006	0.0361	0.0412
Schistosoma mansoni	smad	0.006	0.0361	0.062
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0047	0.0252	0.0433
Trypanosoma brucei	unspecified product	0.002	0.002	0.0252
Trypanosoma brucei	fatty acid desaturase, putative	0.0086	0.0585	0.7566
Echinococcus granulosus	smad	0.006	0.0361	0.0402
Echinococcus multilocularis	tumor protein p63	0.1066	0.8987	1
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.006	0.0361	0.062
Loa Loa (eye worm)	beta-lactamase	0.0108	0.0773	0.0882
Echinococcus multilocularis	smad	0.006	0.0361	0.0402
Trichomonas vaginalis	penicillin-binding protein, putative	0.0108	0.0773	0.0755
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0076	0.0087
Brugia malayi	F/Y-rich N-terminus family protein	0.0019	0.0011	0.0012
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.002	0.002	0.0252
Mycobacterium tuberculosis	Conserved protein	0.0108	0.0773	0.1339
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0108	0.0773	0.0882
Loa Loa (eye worm)	bromodomain containing protein	0.0037	0.0164	0.0187
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0185	0.1433	0.1594
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.0657	0.1128
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0205	0.1606	0.1832
Onchocerca volvulus		0.0086	0.0585	0.0585
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0095	0.0657	0.0731
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.002	0.0022
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0312	0.252	0.2875
Leishmania major	hypothetical protein, conserved	0.0108	0.0773	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0076	0.0057
Brugia malayi	latrophilin 2 splice variant baaae	0.014	0.1049	0.1197
Mycobacterium tuberculosis	Conserved protein	0.0108	0.0773	0.1339
Echinococcus granulosus	mothers against decapentaplegic 2	0.0027	0.0076	0.0085
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0095	0.0657	0.0749
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0046	0.0236	0.3048
Schistosoma mansoni	hypothetical protein	0.0065	0.0403	0.0692
Schistosoma mansoni	hypothetical protein	0.0065	0.0403	0.0692
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.002	0.0252
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0108	0.0773	0.1328
Brugia malayi	MH2 domain containing protein	0.0883	0.7415	0.8457
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0019	0.0008	0.0097
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative	0.0068	0.043	0.3398
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0046	0.0236	0.0262
Echinococcus granulosus	mothers against decapentaplegic 6	0.0027	0.0076	0.0085
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0079	0.0059
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.002	0.0034
Schistosoma mansoni	smad1 5 8 and	0.006	0.0361	0.062
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0156	0.0137
Brugia malayi	MH1 domain containing protein	0.0033	0.0131	0.0149
Entamoeba histolytica	hypothetical protein	0.0183	0.1412	1
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0036	0.0153	0.017
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0126	0.0923	0.1027
Mycobacterium ulcerans	esterase/lipase LipP	0.0108	0.0773	1
Mycobacterium tuberculosis	Probable lipase LipD	0.0108	0.0773	0.1339
Schistosoma mansoni	hypothetical protein	0.0697	0.5823	1
Schistosoma mansoni	transcription factor LCR-F1	0.0183	0.1412	0.2425
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0073	0.0942
Toxoplasma gondii	PHD-finger domain-containing protein	0.003	0.0101	0.0898
Mycobacterium leprae	conserved hypothetical protein	0.0108	0.0773	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0079	0.0059
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0095	0.0657	0.0731
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0149	0.1125	0.1932
Schistosoma mansoni	smad1 5 8 and	0.006	0.0361	0.062
Plasmodium vivax	SET domain protein, putative	0.0149	0.1125	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.002	0.0022
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0179	0.0159
Trypanosoma cruzi	hypothetical protein, conserved	0.0108	0.0773	1
Schistosoma mansoni	jumonji domain containing protein	0.0078	0.0511	0.0877
Echinococcus granulosus	jumonji domain containing protein	0.0041	0.0201	0.0224
Mycobacterium tuberculosis	Probable lipase LipE	0.0108	0.0773	0.1339
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.0657	0.1128
Trichomonas vaginalis	D-aminoacylase, putative	0.0108	0.0773	0.0755
Schistosoma mansoni	Smad4	0.0027	0.0076	0.013
Trypanosoma cruzi	ISWI complex protein	0.0032	0.0122	0.1572
Brugia malayi	beta-lactamase family protein	0.0108	0.0773	0.0882
Echinococcus granulosus	fetal alzheimer antigen falz	0.0047	0.0252	0.0281
Trypanosoma cruzi	fatty acid desaturase, putative	0.0068	0.043	0.5567
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0046	0.0236	0.1552
Brugia malayi	hypothetical protein	0.0183	0.1412	0.161
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0126	0.0923	0.1027
Trichomonas vaginalis	esterase, putative	0.0108	0.0773	0.0755
Echinococcus granulosus	dna polymerase eta	0.002	0.002	0.0022
Brugia malayi	TAR-binding protein	0.0326	0.2639	0.301
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0046	0.0236	0.1552
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0108	0.0773	0.1328
Loa Loa (eye worm)	hypothetical protein	0.0149	0.1122	0.1279
Echinococcus granulosus	tumor protein p63	0.1066	0.8987	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0156	0.0137
Echinococcus granulosus	geminin	0.0697	0.5823	0.6479
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0046	0.0236	0.3048
Onchocerca volvulus		0.0086	0.0585	0.0585
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0108	0.0773	1
Brugia malayi	RNA binding protein	0.0326	0.2639	0.301
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0079	0.0059
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0095	0.0657	0.0749
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0036
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.002	0.0022
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0185	0.1433	0.2461
Brugia malayi	RNA recognition motif domain containing protein	0.0326	0.2639	0.301
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0156	0.0137
Trypanosoma cruzi	DNA polymerase eta, putative	0.002	0.002	0.0252
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Echinococcus granulosus	zinc finger protein	0.0041	0.0199	0.0221
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0073	0.0942
Trichomonas vaginalis	PIKK family atypical protein kinase	0.003	0.0099	0.0079
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0065	0.0403	0.0448
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.002	0.0252
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0156	0.0137
Echinococcus granulosus	beta LACTamase domain containing family member	0.0108	0.0773	0.086
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0065	0.0403	0.0459
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0046	0.0236	0.0405
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0036	0.0153	0.017
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0144	0.1078	0.12
Schistosoma mansoni	zinc finger protein	0.0041	0.0199	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0538	0.0614
Loa Loa (eye worm)	hypothetical protein	0.0086	0.0581	0.0662
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0136	0.0116
Onchocerca volvulus	Mothers against decapentaplegic homolog	0.0027	0.0076	0.0076
Onchocerca volvulus		0.0108	0.0773	0.0773
Brugia malayi	Bromodomain containing protein	0.0035	0.0144	0.0164
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Plasmodium vivax	hypothetical protein, conserved	0.0108	0.0773	0.6655
Onchocerca volvulus		0.0108	0.0773	0.0773
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.002	0.0034
Leishmania major	DNA polymerase kappa, putative	0.002	0.002	0.0252
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0036
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0108	0.0773	0.0882
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.002	0.0252
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0098	0.0683	0.0759
Entamoeba histolytica	hypothetical protein	0.0183	0.1412	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0036	0.0156	0.0137
Echinococcus granulosus	histone lysine methyltransferase setb	0.0185	0.1433	0.1594
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0036	0.0153	0.0263
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0095	0.0657	0.0731
Schistosoma mansoni	hypothetical protein	0.0065	0.0403	0.0692
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0185	0.1433	0.2461
Brugia malayi	MH2 domain containing protein	0.006	0.0361	0.0412
Echinococcus multilocularis	lysine specific demethylase 5A	0.0036	0.0155	0.0172
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.002	0.0252
Trypanosoma brucei	DNA polymerase eta, putative	0.002	0.002	0.0252
Schistosoma mansoni	hypothetical protein	0.003	0.0101	0.0174
Plasmodium vivax	hypothetical protein, conserved	0.003	0.0101	0.0269
Loa Loa (eye worm)	hypothetical protein	0.003	0.0101	0.0115
Echinococcus granulosus	Smad4	0.006	0.0361	0.0402
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.002	0.0252
Schistosoma mansoni	zinc finger protein	0.0032	0.0122	0.0209
Loa Loa (eye worm)	hypothetical protein	0.0205	0.1606	0.1832
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0046	0.0236	0.0262
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0046	0.0236	0.0269
Mycobacterium ulcerans	beta-lactamase	0.0108	0.0773	1
Echinococcus multilocularis	peregrin	0.0035	0.0144	0.016
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.002	0.0022
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.2639	0.4532
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.0236	0.0217
Loa Loa (eye worm)	jmjC domain-containing protein	0.004	0.0189	0.0216
Brugia malayi	Pre-SET motif family protein	0.0149	0.1125	0.1283
Trypanosoma cruzi	ISWI complex protein	0.0032	0.0122	0.1572
Mycobacterium tuberculosis	Probable esterase LipL	0.0108	0.0773	0.1339
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.002	0.0252
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0065	0.0403	0.0448
Schistosoma mansoni	tar DNA-binding protein	0.0326	0.2639	0.4532
Echinococcus granulosus	mothers against decapentaplegic 5	0.006	0.0361	0.0402
Trypanosoma brucei	PAB1-binding protein , putative	0.0027	0.0073	0.0942
Leishmania major	hypothetical protein, conserved	0.0027	0.0073	0.0942
Entamoeba histolytica	hypothetical protein	0.0183	0.1412	1
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0773	0.0882
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0065	0.0403	0.0448
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0034	0.0136	0.1206
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0056	0.0037
Mycobacterium tuberculosis	Conserved protein	0.0108	0.0773	0.1339
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0149	0.1125	1
Schistosoma mansoni	jumonji/arid domain-containing protein	0.004	0.0189	0.0325
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0022	0.003	0.0388
Giardia lamblia	GTOR	0.0046	0.0236	1
Brugia malayi	Pre-SET motif family protein	0.104	0.8767	1
Loa Loa (eye worm)	TAR-binding protein	0.0326	0.2639	0.301
Loa Loa (eye worm)	phosphatidylinositol 3	0.0046	0.0236	0.0269
Echinococcus multilocularis	GPCR, family 2	0.0065	0.0403	0.0448
Echinococcus multilocularis	geminin	0.0697	0.5823	0.6479
Entamoeba histolytica	hypothetical protein	0.0183	0.1412	1
Loa Loa (eye worm)	acyl-CoA desaturase	0.0068	0.043	0.0491
Loa Loa (eye worm)	hypothetical protein	0.009	0.0615	0.0702
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.003	0.0101	0.0174
Onchocerca volvulus		0.0149	0.1125	0.1125

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 19 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.

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: CHEMBL595155

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1090804