TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 450.878 | Formula: C17H16ClFN8O2S
H donors: 1 H acceptors: 7 LogP: 3.02 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)Cn1nnc(n1)c1nnc(s1)N1CC2C(C1)CN(C2)c1cc(F)ccc1Cl
InChi: 1S/C17H16ClFN8O2S/c18-12-2-1-11(19)3-13(12)25-4-9-6-26(7-10(9)5-25)17-22-21-16(30-17)15-20-24-27(23-15)8-14(28)29/h1-3,9-10H,4-8H2,(H,28,29)
InChiKey: WSZOBKWISDXEFE-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
Homo sapiens	stearoyl-CoA desaturase (delta-9-desaturase)	Starlite/ChEMBL	References
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
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty 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
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
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
Plasmodium falciparum	stearoyl-CoA desaturase	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 brucei	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
Trypanosoma congolense	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
Leishmania braziliensis	stearic acid desaturase	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 major	stearic acid 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
Neospora caninum	fatty acyl-CoA desaturase, putative	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
Leishmania braziliensis	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
Leishmania infantum	stearic 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

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
Loa Loa (eye worm)	transcription factor SMAD2	0.0127	0.1541	0.4105
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0008	0.0034	0.0091
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0499	0.133
Leishmania major	stearic acid desaturase, putative	0.0223	0.2761	1
Schistosoma mansoni	smad	0.0009	0.0041	0.0109
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0009	0.0041	0.0109
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0221	0.5297
Trypanosoma cruzi	cytochrome b5-dependent oleate desaturase	0.0018	0.016	0.058
Brugia malayi	RNA, U transporter 1	0.008	0.0949	0.375
Leishmania major	delta-4 fatty acid desaturase	0.0018	0.016	0.058
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0008	0.0034	0.0135
Loa Loa (eye worm)	MH1 domain-containing protein	0.0009	0.0041	0.0109
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0012	0.0082	0.0082
Treponema pallidum	cyclic nucleotide binding protein	0.0005	0	0.5
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Schistosoma mansoni	voltage-gated potassium channel	0.0045	0.05	0.1333
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0008	0.0034	0.0091
Echinococcus granulosus	hyperpolarization activated cyclic	0.0008	0.0034	0.0091
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0221	0.5297
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0008	0.0034	0.082
Plasmodium falciparum	stearoyl-CoA desaturase	0.0205	0.2532	1
Leishmania major	fatty-acid desaturase, putative	0.0223	0.2761	1
Echinococcus multilocularis	Peptidase M, neutral zinc metallopeptidases, zinc binding site	0.0018	0.016	0.016
Echinococcus granulosus	mothers against decapentaplegic 5	0.0009	0.0041	0.0109
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0012	0.0082	0.0219
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0034	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0082	0.0219
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0008	0.0034	0.0091
Echinococcus granulosus	snurportin 1	0.0301	0.3753	1
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0021	0.0195	0.0705
Schistosoma mansoni	hypothetical protein	0.0301	0.3753	1
Onchocerca volvulus		0.0223	0.2761	1
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0289	0.1048
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0041	0.0452	0.1205
Loa Loa (eye worm)	fatty acid desaturase	0.0018	0.016	0.0427
Schistosoma mansoni	voltage-gated potassium channel	0.0045	0.05	0.1333
Echinococcus multilocularis	snurportin 1	0.0301	0.3753	0.3753
Loa Loa (eye worm)	fatty acid desaturase	0.0018	0.016	0.0427
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0499	0.133
Treponema pallidum	cyclic nucleotide binding protein	0.0005	0	0.5
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0008	0.0034	0.0091
Leishmania major	GTP-binding protein, putative	0.0021	0.0195	0.0705
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0021	0.0195	0.0519
Trypanosoma brucei	cytochrome b5-dependent oleate desaturase	0.0018	0.016	0.058
Leishmania major	delta-6 fatty acid desaturase	0.0018	0.016	0.058
Trypanosoma cruzi	fatty acid desaturase, putative	0.0223	0.2761	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0038	0.0418	1
Echinococcus granulosus	importin subunit beta 1	0.0028	0.0289	0.0771
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3	0.0018	0.016	1
Trypanosoma cruzi	delta-4 fatty acid desaturase, putative	0.0018	0.016	0.058
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0289	0.0771
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Treponema pallidum	catabolite gene activator (Crp)	0.0005	0	0.5
Echinococcus multilocularis	voltage gated potassium channel	0.0012	0.0082	0.0082
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0499	0.133
Schistosoma mansoni	voltage-gated potassium channel	0.0012	0.0082	0.0219
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0041	0.0452	0.0452
Schistosoma mansoni	voltage-gated potassium channel	0.0012	0.0082	0.0219
Trypanosoma cruzi	sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Brugia malayi	MH1 domain containing protein	0.0009	0.0041	0.0161
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0008	0.0034	0.0091
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0012	0.0082	0.0325
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0021	0.0195	0.6731
Trypanosoma cruzi	fatty acid desaturase, putative	0.0018	0.016	0.058
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0021	0.0195	0.0769
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0195	0.0705
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0021	0.0195	1
Schistosoma mansoni	ran	0.0021	0.0195	0.0519
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0041	0.0109
Echinococcus multilocularis	Smad4	0.0009	0.0041	0.0041
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0008	0.0034	0.0091
Onchocerca volvulus		0.0223	0.2761	1
Brugia malayi	MH2 domain containing protein	0.0009	0.0041	0.0161
Echinococcus multilocularis	smad	0.0009	0.0041	0.0041
Plasmodium vivax	importin-beta 2, putative	0.0028	0.0289	0.1142
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0499	0.1971
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0499	0.0499
Loa Loa (eye worm)	Smad1	0.0009	0.0041	0.0109
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0021	0.0195	0.0769
Plasmodium falciparum	importin beta, putative	0.0028	0.0289	0.1142
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0301	0.3753	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0008	0.0034	0.0091
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0021	0.0195	0.0195
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0008	0.0034	0.0034
Brugia malayi	MH2 domain containing protein	0.0127	0.1541	0.6086
Schistosoma mansoni	voltage-gated potassium channel	0.0006	0.0013	0.0036
Schistosoma mansoni	importin beta-1	0.0028	0.0289	0.0771
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0499	0.133
Brugia malayi	Importin beta-1 subunit	0.0028	0.0289	0.1142
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0021	0.0195	0.0519
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0195	0.0705
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0008	0.0034	0.0034
Leishmania major	fatty acid desaturase, putative	0.0018	0.016	0.058
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0008	0.0034	0.0091
Echinococcus multilocularis	Fatty acid desaturase, type 1	0.0018	0.016	0.016
Mycobacterium tuberculosis	Probable transmembrane alkane 1-monooxygenase AlkB (alkane 1-hydroxylase) (lauric acid omega-hydroxylase) (omega-hydroxylase) (f	0.0018	0.016	1
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0009	0.0041	0.0041
Echinococcus multilocularis	importin subunit beta 1	0.0028	0.0289	0.0289
Mycobacterium ulcerans	hypothetical protein	0.0018	0.016	1
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0289	0.1048
Entamoeba histolytica	hypothetical protein	0.0023	0.0221	1
Mycobacterium ulcerans	electron transfer protein FdxB	0.0018	0.016	1
Onchocerca volvulus		0.0018	0.016	0.058
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0041	0.0109
Leishmania major	delta-5 fatty acid desaturase	0.0018	0.016	0.058
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0041	0.0452	0.1205
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0008	0.0034	0.0091
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0008	0.0034	0.0034
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0221	0.0802
Trypanosoma brucei	fatty acid desaturase, putative	0.0223	0.2761	1
Schistosoma mansoni	fatty acid desaturase	0.0018	0.016	0.0427
Trypanosoma cruzi	fatty acid desaturase, putative	0.0018	0.016	0.058
Loa Loa (eye worm)	MH2 domain-containing protein	0.0127	0.1541	0.4105
Treponema pallidum	catabolite gene activator	0.0005	0	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0499	0.133
Toxoplasma gondii	sphingolipid delta 4 desaturase/c-4 hydroxylase protein des2 family protein	0.0018	0.016	0.554
Echinococcus granulosus	Smad4	0.0009	0.0041	0.0109
Brugia malayi	acyl-CoA desaturase	0.0205	0.2532	1
Trypanosoma cruzi	delta-4 fatty acid desaturase, putative	0.0018	0.016	0.058
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0221	0.5297
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3_2	0.0018	0.016	1
Mycobacterium leprae	Conserved hypothetical protein	0.0005	0	0.5
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0021	0.0195	0.0769
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0008	0.0034	0.0034
Mycobacterium tuberculosis	Probable conserved membrane protein	0.0018	0.016	1
Echinococcus granulosus	smad	0.0009	0.0041	0.0109
Mycobacterium ulcerans	hypothetical protein	0.0018	0.016	1
Brugia malayi	MH2 domain containing protein	0.0009	0.0041	0.0161
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0009	0.0041	0.0041
Trypanosoma brucei	delta-4 fatty acid desaturase	0.0018	0.016	0.058
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0038	0.0418	1
Schistosoma mansoni	voltage-gated potassium channel	0.0008	0.0034	0.0091
Chlamydia trachomatis	cAMP-dependent protein kinase regulatory subunit	0.0005	0	0.5
Loa Loa (eye worm)	FAT-3 protein	0.0018	0.016	0.0427
Schistosoma mansoni	ran	0.0021	0.0195	0.0519
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0008	0.0034	0.0034
Echinococcus multilocularis	Peptidase M, neutral zinc metallopeptidases, zinc binding site	0.0018	0.016	0.016
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0009	0.0041	0.0109
Trypanosoma brucei	sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Trichomonas vaginalis	ran, putative	0.0021	0.0195	0.4656
Trypanosoma cruzi	fatty acid desaturase, putative	0.0205	0.2532	0.917
Trypanosoma brucei	delta-6 fatty acid desaturase, putative	0.0018	0.016	0.058
Leishmania major	fatty acid desaturase, putative	0.0018	0.016	0.058
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3	0.0018	0.016	1
Brugia malayi	Fatty acid desaturase family protein	0.0018	0.016	0.0633
Brugia malayi	MH1 domain containing protein	0.0009	0.0041	0.0161
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0499	0.133
Echinococcus granulosus	Sphingolipid delta4 desaturase DES1	0.0018	0.016	0.0427
Loa Loa (eye worm)	acyl-CoA desaturase	0.0205	0.2532	0.6745
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0041	0.0452	0.1787
Echinococcus granulosus	Fatty acid desaturase type 1	0.0018	0.016	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0018	0.016	0.0427
Toxoplasma gondii	HEAT repeat-containing protein	0.0028	0.0289	1
Schistosoma mansoni	60S ribosomal protein L21	0.0006	0.0013	0.0036
Schistosoma mansoni	Smad4	0.0009	0.0041	0.0109
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative	0.0205	0.2532	1
Leishmania major	delta-12 fatty acid desaturase	0.0018	0.016	0.058
Brugia malayi	Fatty acid desaturase family protein	0.0018	0.016	0.0633
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0008	0.0034	0.0091
Mycobacterium ulcerans	transmembrane alkane 1-monooxygenase AlkB	0.0018	0.016	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0499	0.0499
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0008	0.0034	0.082
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0221	0.0802
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0384	0.1022
Loa Loa (eye worm)	MH2 domain-containing protein	0.0009	0.0041	0.0109
Mycobacterium tuberculosis	Possible electron transfer protein FdxB	0.0018	0.016	1
Brugia malayi	Smad1	0.0009	0.0041	0.0161
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0008	0.0034	0.0091
Echinococcus granulosus	voltage gated potassium channel	0.0012	0.0082	0.0219
Echinococcus granulosus	hyperpolarization activated cyclic	0.0008	0.0034	0.0091
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0018	0.016	0.058
Trypanosoma cruzi	fatty acid desaturase, putative	0.0205	0.2532	0.917
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0041	0.0109
Brugia malayi	Delta5 fatty acid desaturase	0.0018	0.016	0.0633

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 59 nM	Inhibition of SCD-1 activity in rat liver microsomes assessed as reduction in [1-14C] stearoyl CoA desaturation by scintillation counting	ChEMBL.	22209206
IC50 (binding)	= 300 nM	Inhibition of SCD-1 activity in rat hepatocytes expressing organic anion transporting polypeptides assessed as reduction in [1-14C] stearoyl CoA desaturation by scintillation counting	ChEMBL.	22209206
IC50 (binding)	> 10000 nM	Inhibition of SCD-1 activity in organic anion transporting polypeptides-deficient human HepG2 cells assessed as reduction in [1-14C] stearoyl CoA desaturation by scintillation counting	ChEMBL.	22209206

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: CHEMBL1938873

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 1595038