TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 360.487 | Formula: C22H32O4
H donors: 1 H acceptors: 3 LogP: 5.1 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: C=C[C@]1(C)CC=C2C(C1)CC[C@H]1[C@@]2(C)CCC[C@@]1(C)OC(=O)CC(=O)O
InChi: 1S/C22H32O4/c1-5-20(2)12-9-16-15(14-20)7-8-17-21(16,3)10-6-11-22(17,4)26-19(25)13-18(23)24/h5,9,15,17H,1,6-8,10-14H2,2-4H3,(H,23,24)/t15?,17-,20+,21-,22+/m0/s1
InChiKey: BTAAEEJRNAVSQS-XJCCISBASA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0017	0.029	0.0388
Echinococcus granulosus	acetyl coenzyme A synthetase cytoplasmic	0.0007	0.0032	0.0032
Brugia malayi	Matrixin family protein	0.0114	0.2653	0.4016
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0032	0.0049
Trichomonas vaginalis	replication factor C large subunit, putative	0.001	0.0108	0.245
Brugia malayi	DKFZp564C0469 protein	0.001	0.0108	0.0164
Echinococcus multilocularis	geminin	0.0166	0.3926	0.3926
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0255	0.0341
Brugia malayi	hypothetical protein	0.0036	0.0754	0.1142
Trichomonas vaginalis	conserved hypothetical protein	0.001	0.0108	0.245
Trichomonas vaginalis	importin beta-1, putative	0.0024	0.0443	1
Trypanosoma cruzi	hypothetical protein, conserved	0.001	0.0108	0.186
Schistosoma mansoni	hypothetical protein	0.0036	0.0754	0.1009
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0007	0.0032	0.0071
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0017	0.029	0.0798
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0024	0.0443	1
Toxoplasma gondii	HEAT repeat-containing protein	0.0029	0.0578	1
Schistosoma mansoni	hypothetical protein	0.0016	0.0255	0.0341
Plasmodium falciparum	replication factor C subunit 1, putative	0.001	0.0108	0.1878
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.001	0.0108	0.245
Toxoplasma gondii	ATPase, AAA family protein	0.001	0.0108	0.1878
Loa Loa (eye worm)	hypothetical protein	0.005	0.1097	0.1468
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0433	0.5747
Loa Loa (eye worm)	hypothetical protein	0.0017	0.029	0.0388
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0433	0.1243
Echinococcus multilocularis	nibrin	0.001	0.0108	0.0108
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0433	0.1306
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.001	0.0108	0.1878
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Mycobacterium tuberculosis	Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase)	0.0007	0.0032	0.0071
Leishmania major	importin beta-1 subunit, putative	0.0024	0.0443	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0961	0.0961
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0961	0.0961
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0032	0.0724
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0443	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0754	0.0754
Toxoplasma gondii	Acetyl-coenzyme A synthetase 2, putative	0.0007	0.0032	0.0555
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0433	0.1243
Echinococcus granulosus	nibrin	0.001	0.0108	0.0108
Onchocerca volvulus		0.0114	0.2653	0.4356
Loa Loa (eye worm)	hypothetical protein	0.0017	0.029	0.0388
Trypanosoma brucei	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.001	0.0108	0.1878
Trypanosoma cruzi	FHA domain containing protein, putative	0.001	0.0108	0.186
Schistosoma mansoni	acetyl-CoA synthetase	0.0007	0.0032	0.0043
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0754	0.1009
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0433	0.0656
Brugia malayi	acetyl-Coenzyme A synthetase 2	0.0007	0.0032	0.0049
Brugia malayi	Hemopexin family protein	0.0162	0.3818	0.578
Brugia malayi	Matrixin family protein	0.0276	0.6605	1
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0032	0.0049
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0433	0.0656
Schistosoma mansoni	DNA ligase IV	0.001	0.0108	0.0145
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0961	0.1455
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0433	0.0656
Plasmodium vivax	acetyl-CoA synthetase, putative	0.0007	0.0032	0.0555
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0007	0.0032	0.0071
Schistosoma mansoni	hypothetical protein	0.0166	0.3926	0.5255
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0255	0.0255
Schistosoma mansoni	hypothetical protein	0.0016	0.0255	0.0341
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0433	0.1243
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0433	0.058
Entamoeba histolytica	long-chain-fatty-acid--CoA ligase, putative	0.0007	0.0032	0.0425
Entamoeba histolytica	hypothetical protein	0.0036	0.0754	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0433	0.058
Trypanosoma cruzi	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.001	0.0108	0.186
Brugia malayi	Matrixin family protein	0.0114	0.2653	0.4016
Treponema pallidum	DNA ligase (lig)	0.001	0.0108	0.5
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.001	0.0108	0.245
Mycobacterium ulcerans	NAD-dependent DNA ligase LigA	0.001	0.0108	0.0237
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.1097	0.1661
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.029	0.0864
Echinococcus granulosus	GPCR family 2	0.0016	0.0255	0.0255
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0017	0.029	1
Brugia malayi	hypothetical protein	0.001	0.0108	0.0164
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0167	0.3939	0.5273
Echinococcus granulosus	replication factor c subunit 1	0.001	0.0108	0.0108
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0267	0.0793
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0267	0.0793
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0032	0.0043
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0032	0.0071
Trypanosoma cruzi	hypothetical protein, conserved	0.001	0.0108	0.186
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0032	0.0071
Echinococcus multilocularis	acetyl coenzyme A synthetase, cytoplasmic	0.0007	0.0032	0.0032
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0032	0.0049
Entamoeba histolytica	hypothetical protein	0.0036	0.0754	1
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0443	1
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0007	0.0032	0.0043
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Plasmodium falciparum	acyl-CoA synthetase	0.0017	0.029	0.5016
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0007	0.0032	0.0071
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0032	0.0071
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0707	0.1071
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0433	0.058
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0032	0.0724
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.001	0.0108	0.245
Schistosoma mansoni	hypothetical protein	0.0166	0.3926	0.5255
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0433	0.1243
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0433	0.5747
Loa Loa (eye worm)	hypothetical protein	0.0114	0.2653	0.3551
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0433	0.1306
Echinococcus granulosus	geminin	0.0166	0.3926	0.3926
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0267	0.0793
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0433	0.9784
Loa Loa (eye worm)	matrix metalloproteinase	0.0114	0.2653	0.3551
Plasmodium vivax	acyl-CoA synthetase, putative	0.0017	0.029	0.5016
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0007	0.0032	0.0071
Entamoeba histolytica	hypothetical protein	0.001	0.0108	0.1439
Onchocerca volvulus		0.0162	0.3818	0.6293
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0255	0.0341
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Loa Loa (eye worm)	matrixin family protein	0.0253	0.6048	0.8096
Loa Loa (eye worm)	hypothetical protein	0.0017	0.029	0.0388
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0007	0.0032	0.0071
Schistosoma mansoni	chromosome transmission fidelity factor	0.001	0.0108	0.0145
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0255	0.0386
Echinococcus multilocularis	snurportin 1	0.0311	0.747	0.747
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0253	0.6048	1
Echinococcus granulosus	snurportin 1	0.0311	0.747	0.747
Schistosoma mansoni	importin beta-1	0.0029	0.0578	0.0773
Trichomonas vaginalis	conserved hypothetical protein	0.001	0.0108	0.245
Trypanosoma brucei	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0032	0.0555
Brugia malayi	RNA, U transporter 1	0.0083	0.1891	0.2863
Onchocerca volvulus	Matrilysin homolog	0.0114	0.2653	0.4356
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0433	0.1243
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0311	0.747	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0961	0.1287
Plasmodium vivax	replication factor C subunit 1, putative	0.001	0.0108	0.1878
Schistosoma mansoni	hypothetical protein	0.0034	0.0707	0.0947
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0433	0.1243
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.001	0.0108	0.245
Brugia malayi	Matrixin family protein	0.0114	0.2653	0.4016
Plasmodium falciparum	acetyl-CoA synthetase, putative	0.0007	0.0032	0.0555
Echinococcus granulosus	importin subunit beta 1	0.0029	0.0578	0.0578
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0433	0.9784
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.1097	0.1468
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0961	0.1287
Schistosoma mansoni	hypothetical protein	0.0311	0.747	1
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.0433	0.5747
Schistosoma mansoni	hypothetical protein	0.0162	0.3818	0.511
Trichomonas vaginalis	conserved hypothetical protein	0.001	0.0108	0.245
Leishmania major	acetyl-CoA synthetase, putative	0.0007	0.0032	0.0724
Wolbachia endosymbiont of Brugia malayi	NAD-dependent DNA ligase, Lig	0.001	0.0108	0.5
Onchocerca volvulus	Matrilysin homolog	0.0253	0.6048	1
Loa Loa (eye worm)	hypothetical protein	0.0114	0.2653	0.3551
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0433	0.1243
Entamoeba histolytica	hypothetical protein	0.0036	0.0754	1
Loa Loa (eye worm)	hypothetical protein	0.0139	0.326	0.4364
Brugia malayi	hypothetical protein	0.001	0.0108	0.0164
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0433	0.1243
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0255	0.0255
Schistosoma mansoni	topbp1	0.001	0.0108	0.0145
Schistosoma mansoni	hypothetical protein	0.0016	0.0255	0.0341
Mycobacterium tuberculosis	Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0032	0.0071
Leishmania major	acetyl-CoA synthetase, putative	0.0007	0.0032	0.0724
Brugia malayi	AMP-binding enzyme family protein	0.0007	0.0032	0.0049
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0433	0.1243
Leishmania major	long-chain-fatty-acid-CoA ligase, putative	0.0007	0.0032	0.0724
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0007	0.0032	0.0049
Mycobacterium leprae	PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+])	0.001	0.0108	0.0237
Schistosoma mansoni	topbp1	0.001	0.0108	0.0145
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0754	0.0754
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0114	0.2653	0.3551
Toxoplasma gondii	propionate-CoA ligase	0.0007	0.0032	0.0555
Trypanosoma brucei	acetyl-CoA synthetase, putative	0.0007	0.0032	0.0555
Echinococcus multilocularis	importin subunit beta 1	0.0029	0.0578	0.0578
Plasmodium falciparum	importin beta, putative	0.0029	0.0578	1
Entamoeba histolytica	hypothetical protein	0.0036	0.0754	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0255	0.0255
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0578	0.0773
Trichomonas vaginalis	conserved hypothetical protein	0.001	0.0108	0.245
Echinococcus multilocularis	replication factor c subunit 1	0.001	0.0108	0.0108
Toxoplasma gondii	AMP-binding enzyme domain-containing protein	0.0007	0.0032	0.0555
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0255	0.0386
Onchocerca volvulus		0.001	0.0108	0.0127
Loa Loa (eye worm)	matrixin family protein	0.0276	0.6605	0.8842
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0578	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.1097	0.1661
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0961	0.0961
Mycobacterium ulcerans	hydrolase	0.0139	0.326	1
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.0139	0.326	1
Loa Loa (eye worm)	oxidoreductase	0.0007	0.0032	0.0043
Loa Loa (eye worm)	hypothetical protein	0.001	0.0108	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0707	0.0947
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0415	1	1
Giardia lamblia	Replication factor C, subunit 1	0.001	0.0108	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0961	0.1287
Plasmodium vivax	importin-beta 2, putative	0.0029	0.0578	1
Mycobacterium leprae	PROBABLE HYDROLASE	0.0139	0.326	1
Trichomonas vaginalis	conserved hypothetical protein	0.001	0.0108	0.245
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0139	0.326	0.4936
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0961	0.0961
Entamoeba histolytica	Activator 1 140 kDa subunit, putative	0.001	0.0108	0.1439
Brugia malayi	Importin beta-1 subunit	0.0029	0.0578	0.0875
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0433	0.9784
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0007	0.0032	0.0043
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0007	0.0032	0.0071
Entamoeba histolytica	hypothetical protein	0.0024	0.0443	0.5873
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0961	0.1287
Brugia malayi	Matrixin family protein	0.0114	0.2653	0.4016
Brugia malayi	Pax transcription activation domain interacting protein	0.001	0.0108	0.0164
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0255	0.0255
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0433	0.1243
Schistosoma mansoni	hypothetical protein	0.0016	0.0255	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0114	0.2653	0.3551
Loa Loa (eye worm)	hypothetical protein	0.0017	0.029	0.0388
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0267	0.0793
Brugia malayi	topoisomerase	0.001	0.0108	0.0164
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0032	0.0043
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0578	1
Onchocerca volvulus		0.0023	0.0433	0.0667
Brugia malayi	ATP dependent DNA ligase C terminal region family protein	0.001	0.0108	0.0164
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0255	0.0255

Activities

Activity type	Activity value	Assay description	Source	Reference
MIC (functional)	> 128 ug ml-1	Antimicrobial activity against Escherichia coli imp 389 after 18 hrs by microbroth dilution method	ChEMBL.	12608857

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: CHEMBL446724

Bibliographic References

No literature references available for this target.

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Detailed information for compound 957727