TDR Targets

Basic information

Technical information

TDR Targets ID: 1489488
Name: (3R)-N-cyclopentyl-5-oxo-3,9b-dihydro-2H-[1,3 ]thiazolo[2,3-a]isoindole-3-carboxamide
MW: 302.391 | Formula: C16H18N2O2S
H donors: 1 H acceptors: 2 LogP: 2.16 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: O=C([C@@H]1CSC2N1C(=O)c1c2cccc1)NC1CCCC1
InChi: 1S/C16H18N2O2S/c19-14(17-10-5-1-2-6-10)13-9-21-16-12-8-4-3-7-11(12)15(20)18(13)16/h3-4,7-8,10,13,16H,1-2,5-6,9H2,(H,17,19)/t13-,16?/m0/s1
InChiKey: JJIBLLRLKGBYCX-KNVGNIICSA-N

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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

(3R)-N-cyclopentyl-5-oxo-3,9b-dihydro-2H-thiazolo[2,3-a]isoindole-3-carboxamide
(3R)-N-cyclopentyl-5-keto-3,9b-dihydro-2H-thiazolo[2,3-a]isoindole-3-carboxamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	vitamin D (1,25- dihydroxyvitamin D3) receptor	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	steroid hormone receptor	vitamin D (1,25- dihydroxyvitamin D3) receptor	427 aa	416 aa	24.5 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Plasmodium vivax	SET domain protein, putative	0.0036	0.0414	0.1072
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Onchocerca volvulus		0.0022	0.0177	0.0373
Leishmania major	prostaglandin f synthase, putative	0.0031	0.0322	0.4392
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0041	0.0507	0.6799
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.0177	0.2965
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0322	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0022	0.0177	0.2372
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0041	0.0507	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0041	0.0507	0.6799
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0322	1
Echinococcus granulosus	aldehyde reductase	0.0022	0.0168	0.2245
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Brugia malayi	cathepsin F-like cysteine proteinase	0.0014	0.0038	0.0091
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0589	1	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0022	0.0177	0.2965
Brugia malayi	Pre-SET motif family protein	0.0251	0.4147	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Toxoplasma gondii	histone lysine-specific demethylase	0.0041	0.0507	1
Onchocerca volvulus	Cathepsin F homolog	0.0022	0.0177	0.0373
Echinococcus multilocularis		0.0041	0.0507	0.6799
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0014	0.0038	0.0091
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0036	0.0414	0.5541
Chlamydia trachomatis	protoporphyrinogen oxidase	0.0041	0.0507	0.5
Plasmodium vivax	vivapain-2	0.0022	0.0177	0.0397
Loa Loa (eye worm)	cysteine protease	0.0022	0.0177	0.0427
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0746	0.18
Onchocerca volvulus		0.0022	0.0177	0.0373
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0322	0.0777
Echinococcus granulosus	hypothetical protein	0.0031	0.0322	0.4316
Onchocerca volvulus		0.0022	0.0177	0.0373
Plasmodium falciparum	protoporphyrinogen oxidase	0.0041	0.0507	0.0982
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0746	0.18
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0041	0.0507	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0414	0.5541
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0322	0.0777
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0322	0.0777
Echinococcus multilocularis	aldehyde reductase	0.0022	0.0168	0.2245
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Onchocerca volvulus		0.0286	0.4749	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0022	0.0177	0.2372
Schistosoma mansoni	amine oxidase	0.0041	0.0507	0.6799
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0746	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0746	1
Schistosoma mansoni	pol-related	0.0031	0.0322	0.4316
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Echinococcus multilocularis	cysteine protease	0.0022	0.0177	0.2372
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0746	1
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Echinococcus granulosus	cathepsin l1	0.0022	0.0177	0.2372
Plasmodium vivax	unspecified product	0.0216	0.3543	1
Echinococcus multilocularis	cathepsin L	0.0022	0.0177	0.2372
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0036	0.0414	0.7158
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0022	0.0177	0.0427
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0322	0.0317
Mycobacterium ulcerans	oxidoreductase	0.0041	0.0507	0.0191
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Trypanosoma cruzi	aldo-keto reductase	0.0031	0.0322	0.6055
Leishmania major	aldo-keto reductase-like protein	0.0031	0.0322	0.4392
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0041	0.0507	0.6799
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Plasmodium vivax	hypothetical protein, conserved	0.0041	0.0507	0.134
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0322	0.4316
Plasmodium vivax	unspecified product	0.0202	0.3293	0.9288
Trypanosoma cruzi	cysteine protease, putative	0.0022	0.0177	0.2965
Onchocerca volvulus		0.0022	0.0177	0.0373
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0022	0.0177	0.2372
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0746	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0022	0.0177	0.2965
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0041	0.0507	0.134
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.0177	0.2965
Toxoplasma gondii	aldose reductase, putative	0.0031	0.0322	0.4392
Trypanosoma cruzi	cysteine proteinase, putative	0.0022	0.0177	0.2965
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0322	0.0777
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0038	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0038	0.0091
Onchocerca volvulus		0.0036	0.0414	0.0871
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0322	0.0777
Echinococcus granulosus	cathepsin L cysteine protease	0.0022	0.0177	0.2372
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0036	0.0414	0.5541
Echinococcus multilocularis	cysteine protease	0.0022	0.0177	0.2372
Brugia malayi	Papain family cysteine protease containing protein	0.0022	0.0177	0.0427
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Brugia malayi	Papain family cysteine protease containing protein	0.0022	0.0177	0.0427
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0022	0.0177	0.2372
Plasmodium vivax	hypothetical protein, conserved	0.0041	0.0507	0.134
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0414	0.5541
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0022	0.0177	0.2372
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0041	0.0507	0.0982
Echinococcus granulosus	cysteine protease	0.0022	0.0177	0.2372
Trypanosoma brucei	prostaglandin f synthase	0.0031	0.0322	1
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Onchocerca volvulus		0.0031	0.0322	0.0678
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0322	0.4316
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.4147	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0414	0.5541
Brugia malayi	amine oxidase, flavin-containing family protein	0.0041	0.0507	0.1224
Giardia lamblia	Aldose reductase	0.0031	0.0322	0.5
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0022	0.0177	0.2372
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.4749	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0036	0.0414	0.5541
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0041	0.0507	0.134
Trypanosoma cruzi	cysteine proteinase, putative	0.0022	0.0177	0.2965
Brugia malayi	SWIRM domain containing protein	0.0041	0.0507	0.1224
Plasmodium vivax	vivapain-2	0.0022	0.0177	0.0397
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0322	0.0777
Onchocerca volvulus	Cathepsin L homolog	0.0022	0.0177	0.0373
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0746	1
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0041	0.0507	0.6799
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Loa Loa (eye worm)	oxidoreductase	0.0031	0.0322	0.0777
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0322	0.0317
Echinococcus multilocularis	cathepsin L cysteine protease	0.0022	0.0177	0.2372
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Brugia malayi	Pre-SET motif family protein	0.0036	0.0414	0.0997
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0746	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0507	0.1224
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0322	0.0777
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0414	0.0997
Schistosoma mansoni	aldo-keto reductase	0.0031	0.0322	0.4316
Trypanosoma cruzi	aldo/keto reductase, putative	0.0031	0.0322	0.6055
Plasmodium vivax	vivapain-3	0.0022	0.0177	0.0397
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0041	0.0507	0.6799
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.0177	0.2965
Trypanosoma brucei	aldo-keto reductase, putative	0.0031	0.0322	1
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.0391	0.5233
Schistosoma mansoni	cathepsin s	0.0014	0.0038	0.0506
Onchocerca volvulus		0.0022	0.0177	0.0373
Leishmania major	UDP-galactopyranose mutase	0.0041	0.0507	1
Leishmania major	prostaglandin f2-alpha synthase/D-arabinose dehydrogenase	0.0031	0.0322	0.4392
Mycobacterium ulcerans	dehydrogenase	0.0041	0.0507	0.0191
Onchocerca volvulus	Cathepsin L homolog	0.0022	0.0177	0.0373
Echinococcus granulosus	aldo keto reductase	0.0031	0.0322	0.4316
Mycobacterium tuberculosis	Possible oxidoreductase	0.0041	0.0507	0.0207
Onchocerca volvulus		0.0031	0.0322	0.0678
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0022	0.0177	0.2372
Giardia lamblia	Aldose reductase	0.0031	0.0322	0.5
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0322	0.0777
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0022	0.0177	0.0427
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.0177	0.2965
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0216	0.3543	1
Onchocerca volvulus		0.0031	0.0322	0.0678
Schistosoma mansoni	aldo-keto reductase	0.0031	0.0322	0.4316
Brugia malayi	Cathepsin L-like precursor	0.0014	0.0038	0.0091
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0041	0.0507	0.0982
Onchocerca volvulus		0.0041	0.0507	0.1068
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0014	0.0038	0.0091
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Schistosoma mansoni	amine oxidase	0.0041	0.0507	0.6799
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0041	0.0507	0.0191
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0322	0.4316
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.0414	0.5541
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0022	0.0177	0.2372
Echinococcus granulosus	cathepsin L	0.0022	0.0177	0.2372
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0322	0.0317
Brugia malayi	hypothetical protein	0.0041	0.0507	0.1224
Echinococcus granulosus	aldo keto reductase	0.0031	0.0322	0.4316
Mycobacterium leprae	PROBABLE OXIDOREDUCTASE	0.0031	0.0322	0.4549
Onchocerca volvulus		0.0031	0.0322	0.0678
Entamoeba histolytica	aldose reductase, putative	0.0031	0.0322	1
Onchocerca volvulus		0.0022	0.0177	0.0373
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Loa Loa (eye worm)	fibroinase	0.0022	0.0177	0.0427
Schistosoma mansoni	cathepsin F (C01 family)	0.0022	0.0177	0.2372
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Loa Loa (eye worm)	ctsf protein	0.0022	0.0177	0.0427
Brugia malayi	Papain family cysteine protease containing protein	0.0022	0.0177	0.0427
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0041	0.0507	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.0031	0.0322	0.0317
Plasmodium vivax	vivapain-1	0.0216	0.3543	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0322	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0177	0.0427
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Onchocerca volvulus		0.0031	0.0322	0.0678
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0031	0.0322	0.4316
Leishmania major	aldehyde reductase, putative,oxidoreductase, putative	0.0031	0.0322	0.4392
Brugia malayi	Cathepsin L-like precursor	0.0022	0.0177	0.0427
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0031	0.0322	0.0317
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0031	0.0322	0.4316
Mycobacterium ulcerans	monoamine oxidase	0.0041	0.0507	0.0191
Onchocerca volvulus		0.0031	0.0322	0.0678
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0038	0.0091
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0041	0.0507	0.6799
Trichomonas vaginalis	aldo/keto reductase, putative	0.0031	0.0322	0.0317
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0041	0.0507	1
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0547	0.9281	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0746	1
Echinococcus granulosus	aldo keto reductase	0.0031	0.0322	0.4316
Echinococcus multilocularis	aldo keto reductase	0.0031	0.0322	0.4316
Onchocerca volvulus		0.0022	0.0177	0.0373
Trypanosoma cruzi	cysteine peptidase, putative	0.0022	0.0177	0.2965
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0041	0.0507	0.0207
Schistosoma mansoni	cathepsin F (C01 family)	0.0022	0.0177	0.2372
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0031	0.0322	0.0777

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	2.2387 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	7.0795 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	19.9526 uM	PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855]	ChEMBL.	No reference
Potency (functional)	23.7781 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	112.2018 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference

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: CHEMBL1701344

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1489488