TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 1576.24 | Formula: C81H103ClN16O15
H donors: 14 H acceptors: 16 LogP: 4.66 Rotable bonds: 53
Rule of 5 violations (Lipinski): 4
SMILES: OC[C@@H](C(=O)N[C@H](N(C(=O)c1ccc(cc1)NC(=O)C)C)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C(=O)N)C)CCCCNC(C)C)CC(C)C)Cc1ccc(cc1)NC(=O)C)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2c(c1)cccc2)NC(=O)C)Cc1ccc(cc1)Cl)Cc1cccnc1
InChi: 1S/C81H103ClN16O15/c1-46(2)38-63(72(104)90-62(19-12-13-36-85-47(3)4)81(113)98-37-15-20-69(98)78(110)86-48(5)70(83)103)91-75(107)66(41-53-24-31-60(32-25-53)87-49(6)100)94-79(111)71(97(9)80(112)57-27-33-61(34-28-57)88-50(7)101)96-77(109)68(45-99)95-76(108)67(43-55-16-14-35-84-44-55)93-74(106)65(40-52-22-29-59(82)30-23-52)92-73(105)64(89-51(8)102)42-54-21-26-56-17-10-11-18-58(56)39-54/h10-11,14,16-18,21-35,39,44,46-48,62-69,71,85,99H,12-13,15,19-20,36-38,40-43,45H2,1-9H3,(H2,83,103)(H,86,110)(H,87,100)(H,88,101)(H,89,102)(H,90,104)(H,91,107)(H,92,105)(H,93,106)(H,94,111)(H,95,108)(H,96,109)/t48-,62+,63+,64-,65-,66-,67-,68+,69-,71-/m1/s1
InChiKey: SHWIQHRDLLTLPY-QNVCOSBASA-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

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Gonadotropin-releasing hormone receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	GnHR receptor homolog	Get druggable targets OG5_131719	All targets in OG5_131719

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	peptide (allatostatin)-like receptor	Gonadotropin-releasing hormone receptor	327 aa	272 aa	23.2 %
Loa Loa (eye worm)	hypothetical protein	Gonadotropin-releasing hormone receptor	327 aa	334 aa	21.6 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Gonadotropin-releasing hormone receptor	327 aa	343 aa	21.6 %
Schistosoma japonicum	5-hydroxytryptamine receptor 4, putative	Gonadotropin-releasing hormone receptor	327 aa	305 aa	24.9 %
Echinococcus multilocularis	allatostatin A receptor	Gonadotropin-releasing hormone receptor	327 aa	279 aa	23.7 %
Onchocerca volvulus	Ubiquinol-cytochrome-c reductase complex assembly factor 1 homolog	Gonadotropin-releasing hormone receptor	327 aa	273 aa	19.8 %
Echinococcus granulosus	tm gpcr rhodopsin	Gonadotropin-releasing hormone receptor	327 aa	299 aa	23.1 %
Onchocerca volvulus		Gonadotropin-releasing hormone receptor	327 aa	271 aa	20.7 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Gonadotropin-releasing hormone receptor	327 aa	288 aa	24.3 %
Onchocerca volvulus		Gonadotropin-releasing hormone receptor	327 aa	284 aa	19.4 %
Brugia malayi	ORL1-like opioid receptor	Gonadotropin-releasing hormone receptor	327 aa	293 aa	20.8 %
Echinococcus granulosus	allatostatin A receptor	Gonadotropin-releasing hormone receptor	327 aa	284 aa	22.9 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Gonadotropin-releasing hormone receptor	327 aa	263 aa	23.2 %
Echinococcus multilocularis	neuropeptide receptor	Gonadotropin-releasing hormone receptor	327 aa	263 aa	20.9 %
Onchocerca volvulus		Gonadotropin-releasing hormone receptor	327 aa	292 aa	19.5 %
Schistosoma japonicum	Alpha-1A adrenergic receptor, putative	Gonadotropin-releasing hormone receptor	327 aa	290 aa	19.7 %
Onchocerca volvulus	E3 ubiquitin-protein ligase rpm-1 homolog	Gonadotropin-releasing hormone receptor	327 aa	288 aa	27.8 %
Onchocerca volvulus		Gonadotropin-releasing hormone receptor	327 aa	336 aa	19.0 %
Echinococcus granulosus	tachykinin peptides receptor 99D	Gonadotropin-releasing hormone receptor	327 aa	283 aa	19.1 %
Echinococcus multilocularis	tachykinin peptides receptor 99D	Gonadotropin-releasing hormone receptor	327 aa	283 aa	20.1 %
Schistosoma mansoni	neuropeptide receptor	Gonadotropin-releasing hormone receptor	327 aa	263 aa	24.0 %
Onchocerca volvulus		Gonadotropin-releasing hormone receptor	327 aa	336 aa	20.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.0008	0.0033	0.012
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Echinococcus multilocularis	unc 13 (munc13)	0.0008	0.0033	0.0119
Plasmodium vivax	proteasome subunit beta type-5, putative	0.0005	0	0.5
Schistosoma mansoni	unc-13 (munc13)	0.0008	0.0033	0.0119
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0008	0.0033	0.0119
Entamoeba histolytica	ABC transporter, putative	0.0015	0.0119	1
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0033	0.0119
Echinococcus multilocularis	C2 calcium dependent membrane targeting	0.0008	0.0033	0.0119
Leishmania major	ATP-binding cassette protein subfamily C, member 1, putative	0.0015	0.0119	1
Leishmania major	p-glycoprotein e	0.0015	0.0119	1
Schistosoma mansoni	rac gtpase activating protein	0.0008	0.0033	0.0119
Brugia malayi	protein kinase C II.	0.0008	0.0033	0.0047
Echinococcus granulosus	multidrug resistance associated protein 4	0.0011	0.0076	0.0272
Plasmodium vivax	proteasome subunit alpha type-7, putative	0.0005	0	0.5
Echinococcus granulosus	Diacylglycerol kinase theta	0.0008	0.0033	0.0119
Brugia malayi	diacylglycerol kinase	0.0008	0.0033	0.0047
Schistosoma mansoni	multidrug resistance protein	0.0015	0.0119	0.0427
Plasmodium falciparum	proteasome subunit alpha type-7, putative	0.0005	0	0.5
Giardia lamblia	Multidrug resistance-associated protein 1	0.0014	0.0117	0.9874
Brugia malayi	diacylglycerol kinase	0.0008	0.0033	0.0047
Plasmodium falciparum	proteasome subunit alpha type-3, putative	0.0005	0	0.5
Schistosoma mansoni	multidrug resistance protein	0.0015	0.0119	0.0427
Plasmodium vivax	proteasome subunit beta type-1, putative	0.0005	0	0.5
Brugia malayi	Raf kinase	0.0216	0.2687	0.3813
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Plasmodium vivax	proteasome subunit alpha type-5, putative	0.0005	0	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0224	0.2787	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0015	0.0119	1
Plasmodium vivax	proteasome subunit alpha type-1, putative	0.0005	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0033	0.0119
Entamoeba histolytica	hypothetical protein	0.0015	0.0119	1
Echinococcus multilocularis	multidrug resistance associated protein 7	0.0015	0.0119	0.0427
Echinococcus multilocularis	N chimaerin	0.0008	0.0033	0.0119
Plasmodium falciparum	proteasome subunit beta type-1, putative	0.0005	0	0.5
Onchocerca volvulus		0.0008	0.0033	1
Echinococcus multilocularis	myotubularin protein 13	0.0008	0.0033	0.0119
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Brugia malayi	RhoGEF domain containing protein	0.0008	0.0033	0.0047
Echinococcus granulosus	C2 calcium dependent membrane targeting	0.0008	0.0033	0.0119
Schistosoma mansoni	multidrug resistance protein	0.0015	0.0119	0.0427
Plasmodium falciparum	proteasome subunit beta type-6, putative	0.0005	0	0.5
Trypanosoma brucei	p-glycoprotein	0.0015	0.0119	1
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Echinococcus multilocularis	protein kinase c iota type	0.0008	0.0033	0.0119
Leishmania major	ATP-binding cassette protein subfamily C, member 2, putative	0.0015	0.0119	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0117	0.0423
Plasmodium vivax	proteasome subunit beta type-4, putative	0.0005	0	0.5
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.0008	0.0033	0.0119
Plasmodium falciparum	proteasome subunit beta type-4	0.0005	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Plasmodium vivax	proteasome subunit beta type-3, putative	0.0005	0	0.5
Trypanosoma cruzi	hypothetical protein	0.0011	0.0076	0.6384
Brugia malayi	Ras association domain family 1 isoform A	0.0008	0.0033	0.0047
Giardia lamblia	Multidrug resistance-associated protein 1	0.0015	0.0119	1
Schistosoma mansoni	unc-13 (munc13)	0.0008	0.0033	0.0119
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0119	0.0429
Plasmodium falciparum	proteasome subunit alpha type-1, putative	0.0005	0	0.5
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0015	0.0119	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Echinococcus granulosus	unc 13 munc13	0.0008	0.0033	0.0119
Trypanosoma cruzi	multidrug resistance protein E, putative	0.0015	0.0119	1
Loa Loa (eye worm)	AGC/PKC/IOTA protein kinase	0.0008	0.0033	0.012
Loa Loa (eye worm)	raf kinase	0.0223	0.2773	1
Loa Loa (eye worm)	multidrug resistance-associated protein	0.0011	0.0077	0.0279
Echinococcus granulosus	multidrug resistance associated protein 1	0.0015	0.0119	0.0427
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0015	0.0119	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Schistosoma mansoni	vav2	0.0008	0.0033	0.0119
Entamoeba histolytica	diacylglycerol kinase, putative	0.0008	0.0033	0.2793
Schistosoma mansoni	hypothetical protein	0.0008	0.0033	0.0119
Entamoeba histolytica	hypothetical protein	0.0008	0.0033	0.2793
Entamoeba histolytica	multidrug resistance protein, putative	0.0015	0.0119	1
Plasmodium falciparum	proteasome subunit beta type-5	0.0005	0	0.5
Echinococcus granulosus	raf serine:threonine protein kinase	0.0224	0.2787	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.0008	0.0033	0.012
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.0008	0.0033	0.0119
Brugia malayi	Protein kinase domain containing protein	0.0008	0.0033	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Plasmodium falciparum	proteasome subunit alpha type-5, putative	0.0005	0	0.5
Trypanosoma brucei	multidrug resistance protein E	0.0015	0.0119	1
Brugia malayi	protein kinase C3,putative	0.0008	0.0033	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Plasmodium falciparum	proteasome subunit beta type-3, putative	0.0005	0	0.5
Brugia malayi	ABC transporter transmembrane region family protein	0.0015	0.0119	0.0169
Leishmania major	pentamidine resistance protein 1	0.0015	0.0119	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Schistosoma mansoni	protein kinase C mu	0.0008	0.0033	0.0119
Plasmodium vivax	proteasome subunit alpha type-4, putative	0.0005	0	0.5
Brugia malayi	Pleckstrin Homology Domain	0.0008	0.0033	0.0047
Plasmodium vivax	ATP-dependent protease subunit ClpQ, putative	0.0005	0	0.5
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0224	0.2787	1
Schistosoma mansoni	atypical protein kinase C	0.0008	0.0033	0.0119
Leishmania major	ATP-binding cassette protein subfamily C, member 6, putative	0.0015	0.0119	1
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0033	0.0119
Echinococcus multilocularis	protein kinase c epsilon type	0.0008	0.0033	0.0119
Echinococcus multilocularis	multidrug resistance associated protein 4	0.0011	0.0076	0.0272
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0015	0.0119	1
Echinococcus granulosus	protein kinase c eta type	0.0008	0.0033	0.0119
Echinococcus multilocularis	multidrug resistance associated protein 1	0.0015	0.0119	0.0427
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Schistosoma mansoni	diacylglycerol kinase theta	0.0008	0.0033	0.0119
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Plasmodium vivax	proteasome subunit alpha type-6, putative	0.0005	0	0.5
Giardia lamblia	Multidrug resistance-associated protein 1	0.0015	0.0119	1
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Plasmodium vivax	proteasome subunit beta type-7, putative	0.0005	0	0.5
Echinococcus granulosus	multidrug resistance associated protein 7	0.0015	0.0119	0.0427
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Plasmodium vivax	proteasome subunit alpha type-3, putative	0.0005	0	0.5
Onchocerca volvulus		0.0008	0.0033	1
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Schistosoma mansoni	diacylglycerol kinase theta	0.0008	0.0033	0.0119
Wolbachia endosymbiont of Brugia malayi	ATP-dependent protease peptidase subunit	0.0005	0	0.5
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0008	0.0033	0.0119
Brugia malayi	Variant SH3 domain containing protein	0.0008	0.0033	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Brugia malayi	RhoGAP domain containing protein	0.0008	0.0033	0.0047
Leishmania major	ABC-thiol transporter	0.0015	0.0119	1
Echinococcus multilocularis	Rac GTPase activating protein 1	0.0008	0.0033	0.0119
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0005	0	0.5
Echinococcus granulosus	protein kinase c epsilon type	0.0008	0.0033	0.0119
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0015	0.0119	1
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.0008	0.0033	0.0119
Brugia malayi	Phorbol esters/diacylglycerol binding domain	0.0008	0.0033	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0033	0.012
Echinococcus multilocularis	Diacylglycerol kinase theta	0.0008	0.0033	0.0119
Brugia malayi	multidrug resistance related protein 1	0.0015	0.0119	0.0169
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0015	0.0119	1
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0033	0.0119
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Plasmodium falciparum	proteasome subunit alpha type-2, putative	0.0005	0	0.5
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0015	0.0119	1
Giardia lamblia	MRP-like ABC transporter	0.0015	0.0119	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0119	0.0429
Brugia malayi	Protein kinase c protein 2	0.0008	0.0033	0.0047
Leishmania major	ATP-binding cassette protein subfamily C, member 5, putative	0.0015	0.0119	1
Plasmodium falciparum	ATP-dependent protease subunit ClpQ	0.0005	0	0.5
Plasmodium vivax	proteasome subunit beta type-2, putative	0.0005	0	0.5
Schistosoma mansoni	multidrug resistance protein	0.0015	0.0119	0.0427
Plasmodium falciparum	proteasome subunit alpha type-4, putative	0.0005	0	0.5
Echinococcus multilocularis	protein kinase c eta type	0.0008	0.0033	0.0119
Brugia malayi	RhoGAP domain containing protein	0.0008	0.0033	0.0047
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0008	0.0033	0.012
Onchocerca volvulus		0.0008	0.0033	1
Mycobacterium tuberculosis	Proteasome alpha subunit PrcA; assembles with beta subunit PrcB.	0.079	1	1
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Plasmodium vivax	proteasome subunit alpha type-2, putative	0.0005	0	0.5
Toxoplasma gondii	diacylglycerol kinase, putative	0.0008	0.0033	0.2793
Schistosoma mansoni	serine/threonine protein kinase	0.0008	0.0033	0.0119
Plasmodium falciparum	proteasome subunit beta type-2, putative	0.0005	0	0.5
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0015	0.0119	1
Schistosoma mansoni	protein kinase C mu	0.0008	0.0033	0.0119
Plasmodium vivax	proteasome subunit beta type-6, putative	0.0005	0	0.5
Mycobacterium ulcerans	proteasome PrcA	0.079	1	1
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0008	0.0033	0.0119
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.0008	0.0033	0.0119
Loa Loa (eye worm)	RasGEF domain-containing protein	0.0008	0.0033	0.012
Echinococcus granulosus	protein kinase c iota type	0.0008	0.0033	0.0119
Schistosoma mansoni	protein kinase C	0.0008	0.0033	0.0119
Brugia malayi	GnHR receptor homolog	0.0558	0.7048	1
Plasmodium falciparum	proteasome subunit alpha type-6, putative	0.0005	0	0.5
Echinococcus granulosus	Protein kinase C brain isozyme	0.0008	0.0033	0.0119
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0008	0.0033	0.012
Trichomonas vaginalis	Family T1, proteasome alpha subunit, threonine peptidase	0.0005	0	0.5
Entamoeba histolytica	diacylglycerol kinase, putative	0.0008	0.0033	0.2793
Echinococcus granulosus	N chimaerin	0.0008	0.0033	0.0119
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.0015	0.0119	0.0429
Loa Loa (eye worm)	TKL/RAF/RAF protein kinase	0.0127	0.1551	0.5595
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0015	0.0119	1
Loa Loa (eye worm)	Ras association domain family 1 isoform A	0.0008	0.0033	0.012
Giardia lamblia	ABC transporter, putative	0.0015	0.0119	1
Brugia malayi	C1-like domain containing protein	0.0008	0.0033	0.0047
Plasmodium falciparum	proteasome subunit beta type-7, putative	0.0005	0	0.5
Echinococcus granulosus	Rac GTPase activating protein 1	0.0008	0.0033	0.0119
Echinococcus granulosus	myotubularin protein 13	0.0008	0.0033	0.0119

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.43 nM	Inhibition of binding of radiolabeled histrelin to Gonadotropin-releasing hormone receptor (GnRHr) in rat pituitary gland membranes	ChEMBL.	9371239
IC50 (binding)	= 0.43 nM	Inhibition of binding of radiolabeled histrelin to Gonadotropin-releasing hormone receptor (GnRHr) in rat pituitary gland membranes	ChEMBL.	9371239
ov. rat/total (functional)	0	Ratio of ovulated rats to total number of rats determined in a anti-ovulatory assay by administering 2.5 microg of compound; 0/8	ChEMBL.	9371239
ov. rat/total (functional)	0	Ratio of ovulated rats to total number of rats determined in a anti-ovulatory assay by administering 1 microg of compound; 5/8	ChEMBL.	9371239

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: CHEMBL407681

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 402793