TDR Targets

Basic information

Technical information

TDR Targets ID: 1447607
Name: SMR000343425
MW: 291.346 | Formula: C15H21N3O3
H donors: 0 H acceptors: 3 LogP: 1.74 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCC(CC1)N(C(=O)Cc1ccccc1[N+](=O)[O-])C
InChi: 1S/C15H21N3O3/c1-16-9-7-13(8-10-16)17(2)15(19)11-12-5-3-4-6-14(12)18(20)21/h3-6,13H,7-11H2,1-2H3
InChiKey: QUUCGDRLXJATEM-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

T5264208
MLS000517393

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
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
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
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
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	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
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	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 japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
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

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
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
Leishmania major	delta-4 fatty acid desaturase	0.0259	0.2063	0.2021
Echinococcus granulosus	bloom syndrome protein	0.002	0.0128	0.0467
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0015	0.009	0.0038
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0414	0.1876
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0414	0.1876
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0009	0.0036	0.0015
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0015	0.009	0.0038
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0247	0.0272
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0414	0.0484
Mycobacterium tuberculosis	Probable transmembrane alkane 1-monooxygenase AlkB (alkane 1-hydroxylase) (lauric acid omega-hydroxylase) (omega-hydroxylase) (f	0.0259	0.2063	1
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0015	0.009	0.0073
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Brugia malayi	Fatty acid desaturase family protein	0.0259	0.2063	0.258
Loa Loa (eye worm)	thioredoxin reductase	0.0044	0.0324	0.041
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.0015	0.009	0.0073
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.0562	0.2725
Echinococcus multilocularis	Fatty acid desaturase, type 1	0.0259	0.2063	1
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3	0.0259	0.2063	1
Mycobacterium ulcerans	hypothetical protein	0.0259	0.2063	1
Schistosoma mansoni	fatty acid desaturase	0.0259	0.2063	1
Giardia lamblia	NADH oxidase lateral transfer candidate	0.0015	0.009	1
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0112	0.0874	0.3974
Trypanosoma cruzi	fatty acid desaturase, putative	0.1238	1	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0036	0.0015
Mycobacterium ulcerans	transmembrane alkane 1-monooxygenase AlkB	0.0259	0.2063	1
Leishmania major	delta-6 fatty acid desaturase	0.0259	0.2063	0.2021
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.0498	0.2416
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0053	0.0067
Loa Loa (eye worm)	FAT-3 protein	0.0259	0.2063	0.261
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Trypanosoma brucei	sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2021
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0101	0.0783	0.3512
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0101	0.0783	0.3512
Mycobacterium tuberculosis	Probable reductase	0.0101	0.0783	0.3512
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0112	0.0874	0.3974
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0015	0.009	0.0038
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0101	0.0783	0.3512
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0036	0.0015
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Trichomonas vaginalis	glutathione reductase, putative	0.0015	0.009	0.7057
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Treponema pallidum	NADH oxidase	0.0015	0.009	1
Brugia malayi	acyl-CoA desaturase	0.0979	0.7903	1
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0015	0.009	0.0038
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Trypanosoma cruzi	trypanothione reductase, putative	0.0015	0.009	0.009
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Echinococcus granulosus	cpg binding protein	0.0037	0.0263	0.1134
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0008	0.0033	0.0041
Mycobacterium ulcerans	hypothetical protein	0.0259	0.2063	1
Trypanosoma cruzi	delta-4 fatty acid desaturase, putative	0.0259	0.2063	0.2063
Leishmania major	delta-5 fatty acid desaturase	0.0259	0.2063	0.2021
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0015	0.009	0.0437
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3_2	0.0259	0.2063	1
Trypanosoma cruzi	fatty acid desaturase, putative	0.0979	0.7903	0.7903
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0015	0.009	0.009
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2021
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0044	0.0324	0.1186
Echinococcus multilocularis	Peptidase M, neutral zinc metallopeptidases, zinc binding site	0.0259	0.2063	1
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0036	0.0174
Leishmania major	trypanothione reductase	0.0044	0.0324	0.0273
Brugia malayi	Thioredoxin reductase	0.0044	0.0324	0.037
Trypanosoma brucei	delta-4 fatty acid desaturase	0.0259	0.2063	0.2021
Trypanosoma cruzi	fatty acid desaturase, putative	0.0259	0.2063	0.2063
Trypanosoma brucei	fatty acid desaturase, putative	0.1238	1	1
Echinococcus granulosus	Fatty acid desaturase type 1	0.0259	0.2063	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0112	0.0874	0.3974
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0009	0.0036	0.0015
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0044	0.0324	0.1435
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Loa Loa (eye worm)	fatty acid desaturase	0.0259	0.2063	0.261
Mycobacterium tuberculosis	Probable dehydrogenase	0.0101	0.0783	0.3512
Echinococcus multilocularis	bloom syndrome protein	0.002	0.0128	0.0467
Onchocerca volvulus		0.1238	1	1
Onchocerca volvulus		0.0259	0.2063	0.1862
Mycobacterium tuberculosis	Probable conserved membrane protein	0.0259	0.2063	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0044	0.0324	0.0324
Schistosoma mansoni	DNA helicase recq5	0.0008	0.0033	0.0159
Trypanosoma cruzi	cytochrome b5-dependent oleate desaturase	0.0259	0.2063	0.2063
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.0015	0.009	0.0073
Trichomonas vaginalis	mercuric reductase, putative	0.0015	0.009	0.7057
Trichomonas vaginalis	DNA helicase recq1, putative	0.002	0.0128	1
Loa Loa (eye worm)	acyl-CoA desaturase	0.0979	0.7903	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.0038
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0052	0.0024
Leishmania major	fatty-acid desaturase, putative	0.1238	1	1
Trypanosoma cruzi	fatty acid desaturase, putative	0.0979	0.7903	0.7903
Onchocerca volvulus		0.1238	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0101	0.0783	0.3512
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0112	0.0874	1
Plasmodium falciparum	glutathione reductase	0.0044	0.0324	0.037
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.0041
Echinococcus multilocularis	Peptidase M, neutral zinc metallopeptidases, zinc binding site	0.0259	0.2063	1
Echinococcus multilocularis	cpg binding protein	0.0037	0.0263	0.1134
Echinococcus granulosus	thioredoxin glutathione reductase	0.0044	0.0324	0.1435
Trypanosoma cruzi	sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2063
Schistosoma mansoni	cpg binding protein	0.0037	0.0263	0.1275
Loa Loa (eye worm)	hypothetical protein	0.0259	0.2063	0.261
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0247	0.0313
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.0038
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0015	0.009	0.5
Trypanosoma cruzi	delta-4 fatty acid desaturase, putative	0.0259	0.2063	0.2063
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0053	0.01
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.003	0.2315
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2021
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0414	0.2005
Trichomonas vaginalis	helicase, putative	0.0008	0.003	0.2315
Plasmodium falciparum	glutathione reductase	0.0015	0.009	0.0073
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Loa Loa (eye worm)	fatty acid desaturase	0.0259	0.2063	0.261
Plasmodium vivax	glutathione reductase, putative	0.0044	0.0324	0.0318
Mycobacterium ulcerans	linoleoyl-CoA desaturase, DesA3	0.0259	0.2063	1
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0008	0.0033	0.0159
Entamoeba histolytica	recQ family helicase, putative	0.0011	0.0052	1
Brugia malayi	glutathione reductase	0.0044	0.0324	0.037
Trichomonas vaginalis	DNA helicase recq, putative	0.0011	0.0052	0.4094
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0015	0.009	0.0437
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2021
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0015	0.009	0.0038
Loa Loa (eye worm)	RecQ helicase	0.002	0.0128	0.0161
Plasmodium falciparum	stearoyl-CoA desaturase	0.0979	0.7903	1
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0015	0.009	0.0283
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0015	0.009	0.0038
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0011	0.0052	0.0052
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0015	0.009	0.5
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0005	0.0006	0.0031
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.003	0.2315
Schistosoma mansoni	cpg binding protein	0.0037	0.0263	0.1275
Echinococcus granulosus	Sphingolipid delta4 desaturase DES1	0.0259	0.2063	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Trypanosoma brucei	cytochrome b5-dependent oleate desaturase	0.0259	0.2063	0.2021
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0015	0.009	0.009
Plasmodium vivax	thioredoxin reductase, putative	0.0044	0.0324	0.0318
Leishmania major	delta-12 fatty acid desaturase	0.0259	0.2063	0.2021
Mycobacterium tuberculosis	Possible electron transfer protein FdxB	0.0259	0.2063	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0414	0.1876
Loa Loa (eye worm)	glutathione reductase	0.0044	0.0324	0.041
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0011	0.0057	0.0031
Brugia malayi	Delta5 fatty acid desaturase	0.0259	0.2063	0.258
Schistosoma mansoni	blooms syndrome DNA helicase	0.0016	0.0094	0.0454
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.0015	0.009	0.0019
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0013	0.0074	0.0359
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Leishmania major	fatty acid desaturase, putative	0.0259	0.2063	0.2021
Schistosoma mansoni	cpg binding protein	0.0035	0.0247	0.1197
Brugia malayi	Fatty acid desaturase family protein	0.0259	0.2063	0.258
Plasmodium vivax	stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative	0.0979	0.7903	1
Brugia malayi	Bloom's syndrome protein homolog	0.002	0.0128	0.0121
Plasmodium falciparum	thioredoxin reductase	0.0044	0.0324	0.037
Trichomonas vaginalis	DNA helicase recq, putative	0.002	0.0128	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0053	0.01
Schistosoma mansoni	DNA helicase recq1	0.0008	0.0033	0.0159
Toxoplasma gondii	thioredoxin reductase	0.0044	0.0324	0.1571
Plasmodium falciparum	thioredoxin reductase	0.0015	0.009	0.0073
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0414	0.2005
Toxoplasma gondii	sphingolipid delta 4 desaturase/c-4 hydroxylase protein des2 family protein	0.0259	0.2063	1
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0018	0.0108	0.0096
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0015	0.009	0.0283
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0004	0	0.0000000021584
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0414	0.1876
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0414	0.2005
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0015	0.009	0.009
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.0015	0.009	0.0019
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0008	0.0033	0.0159
Leishmania major	fatty acid desaturase, putative	0.0259	0.2063	0.2021
Trypanosoma brucei	trypanothione reductase	0.0044	0.0324	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0095	0.012
Mycobacterium ulcerans	electron transfer protein FdxB	0.0259	0.2063	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.003	0.2315
Toxoplasma gondii	NADPH-glutathione reductase	0.0015	0.009	0.0437
Trypanosoma cruzi	fatty acid desaturase, putative	0.0259	0.2063	0.2063
Leishmania major	fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative	0.0259	0.2063	0.2021
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0015	0.009	0.5
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.003	0.2315
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0414	0.0523
Trypanosoma brucei	delta-6 fatty acid desaturase, putative	0.0259	0.2063	0.2021
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0011	0.0057	0.0031

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 8.9125 um	PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)]	ChEMBL.	No reference
Potency (functional)	11.2202 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)	19.9526 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23

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: CHEMBL1597053

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 1447607