TDR Targets

Basic information

Technical information

TDR Targets ID: 27653
Name: N-[2-(3,4-dihydro-2H-chromen-8-yloxy)ethyl]-4 -(4-methoxyphenyl)butan-1-amine
MW: 355.471 | Formula: C22H29NO3
H donors: 1 H acceptors: 0 LogP: 4.47 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1)CCCCNCCOc1cccc2c1OCCC2
InChi: 1S/C22H29NO3/c1-24-20-12-10-18(11-13-20)6-2-3-14-23-15-17-25-21-9-4-7-19-8-5-16-26-22(19)21/h4,7,9-13,23H,2-3,5-6,8,14-17H2,1H3
InChiKey: RHNWSBLMCVFMKW-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

N-(2-chroman-8-yloxyethyl)-4-(4-methoxyphenyl)butan-1-amine
N-[2-(3,4-dihydro-2H-1-benzopyran-8-yloxy)ethyl]-4-(4-methoxyphenyl)-1-butanamine
2-chroman-8-yloxyethyl-[4-(4-methoxyphenyl)butyl]amine
N-[2-(8-chromanyloxy)ethyl]-4-(4-methoxyphenyl)butan-1-amine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Dopamine D2 receptor	Starlite/ChEMBL	References
Rattus norvegicus	Serotonin 1a (5-HT1a) receptor	Starlite/ChEMBL	References
Rattus norvegicus	Adrenergic receptor alpha-1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	expressed protein	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_133249	All targets in OG5_133249
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus granulosus	biogenic amine 5HT receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	ko:K04153 5-hydroxytryptamine (serotonin) receptor 1A, putative	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma mansoni	biogenic amine (5HT) receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	Octopamine receptor, putative	Get druggable targets OG5_133249	All targets in OG5_133249

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	24.3 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	426 aa	29.6 %
Schistosoma mansoni	biogenic amine (dopamine) receptor	Dopamine D2 receptor	444 aa	494 aa	26.3 %
Onchocerca volvulus	Glycoprotein hormone beta 5 homolog	Serotonin 1a (5-HT1a) receptor	422 aa	477 aa	24.3 %
Echinococcus multilocularis	neuropeptides capa receptor	Serotonin 1a (5-HT1a) receptor	422 aa	430 aa	20.0 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Serotonin 1a (5-HT1a) receptor	422 aa	383 aa	30.5 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	433 aa	22.4 %
Echinococcus multilocularis	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.2 %
Loa Loa (eye worm)	hypothetical protein	Serotonin 1a (5-HT1a) receptor	422 aa	388 aa	26.5 %
Echinococcus granulosus	biogenic amine 5HT receptor	Dopamine D2 receptor	444 aa	429 aa	31.7 %
Echinococcus multilocularis	serotonin receptor	Dopamine D2 receptor	444 aa	428 aa	31.3 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.6 %
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Serotonin 1a (5-HT1a) receptor	422 aa	444 aa	29.3 %
Schistosoma mansoni	amine GPCR	Serotonin 1a (5-HT1a) receptor	422 aa	440 aa	31.6 %
Schistosoma japonicum	Octopamine receptor, putative	Dopamine D2 receptor	444 aa	456 aa	29.4 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Serotonin 1a (5-HT1a) receptor	422 aa	448 aa	29.7 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	390 aa	33.6 %
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	Serotonin 1a (5-HT1a) receptor	422 aa	350 aa	20.6 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Serotonin 1a (5-HT1a) receptor	422 aa	339 aa	23.0 %
Schistosoma japonicum	Octopamine receptor 1, putative	Serotonin 1a (5-HT1a) receptor	422 aa	424 aa	24.3 %
Echinococcus granulosus	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.0 %
Schistosoma mansoni	biogenic amine receptor	Dopamine D2 receptor	444 aa	452 aa	30.1 %
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	Dopamine D2 receptor	444 aa	487 aa	23.8 %
Echinococcus granulosus	alpha 1A adrenergic receptor	Serotonin 1a (5-HT1a) receptor	422 aa	452 aa	21.0 %
Schistosoma japonicum	ko:K04145 dopamine receptor D2, putative	Serotonin 1a (5-HT1a) receptor	422 aa	410 aa	27.8 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	392 aa	20.7 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.4 %
Onchocerca volvulus	RB1-inducible coiled-coil protein 1 homolog	Dopamine D2 receptor	444 aa	474 aa	23.4 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	407 aa	23.3 %
Loa Loa (eye worm)	TYRA-2 protein	Serotonin 1a (5-HT1a) receptor	422 aa	491 aa	27.3 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	436 aa	23.9 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	417 aa	21.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.0584	0.3087	0.3074
Mycobacterium leprae	Possible secreted protease	0.0092	0.0305	0.5
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0092	0.0305	0.5
Echinococcus multilocularis	protein will die slowly	0.0137	0.0557	0.0686
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Echinococcus multilocularis	Mastin	0.0057	0.0107	0.0113
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0092	0.0305	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Echinococcus multilocularis	serotonin receptor	0.0163	0.0708	0.0878
Toxoplasma gondii	subtilisin SUB12	0.0092	0.0305	1
Echinococcus granulosus	Furin 1	0.0584	0.3087	0.3074
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0092	0.0305	0.0287
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Toxoplasma gondii	subtilisin SUB8	0.0092	0.0305	1
Echinococcus granulosus	neuroendocrine convertase 2	0.1429	0.7868	0.7864
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0092	0.0305	0.0287
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Brugia malayi	proprotein convertase 2	0.1429	0.7868	0.7864
Echinococcus multilocularis	epidermal growth factor receptor	0.0321	0.1599	0.2013
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.1806	1	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Loa Loa (eye worm)	endoprotease bli-4	0.1806	1	1
Schistosoma mansoni	tyrosine kinase	0.0321	0.1599	0.1583
Trypanosoma cruzi	subtilisin peptidase	0.0092	0.0305	0.5
Echinococcus multilocularis		0.1389	0.7642	0.9712
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Schistosoma mansoni	inhibitor of apoptosis (iap) domain family member	0.0106	0.0386	0.0368
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0092	0.0305	0.0287
Leishmania major	subtilisin-like serine peptidase	0.0092	0.0305	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0167	0.0729	0.0712
Plasmodium vivax	subtilisin-like protease 2, putative	0.0092	0.0305	1
Plasmodium falciparum	subtilisin-like protease 1	0.0092	0.0305	1
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0092	0.0305	0.0287
Echinococcus multilocularis	baculoviral IAP repeat containing protein	0.0106	0.0386	0.0468
Echinococcus multilocularis	glycoprotein Antigen 5	0.0057	0.0107	0.0113
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Giardia lamblia	Furin precursor putative serine protease	0.0492	0.2566	1
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0019	0.0036
Brugia malayi	celfurPC protein	0.1389	0.7642	0.7638
Schistosoma mansoni	furin-1 (S08 family)	0.0937	0.5086	0.5077
Onchocerca volvulus		0.0304	0.1502	1
Toxoplasma gondii	subtilisin SUB5	0.0092	0.0305	1
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.0305	0.0584
Toxoplasma gondii	subtilisin SUB9	0.0092	0.0305	1
Echinococcus granulosus	epidermal growth factor receptor	0.0321	0.1599	0.1583
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0092	0.0305	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0092	0.0305	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	conserved hypothetical protein	0.0075	0.0208	0.0399
Trichomonas vaginalis	WD repeat domain, putative	0.0137	0.0557	0.1068
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0092	0.0305	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Plasmodium falciparum	subtilisin-like protease 3	0.0092	0.0305	1
Brugia malayi	Protein kinase domain containing protein	0.0943	0.512	0.5111
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.0305	0.0584
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0189	0.0189
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0019	0.0036
Echinococcus granulosus	baculoviral IAP repeat containing protein	0.0106	0.0386	0.0368
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Plasmodium vivax	subtilisin-like protease 1	0.0092	0.0305	1
Brugia malayi	Will die slowly protein	0.0137	0.0557	0.054
Loa Loa (eye worm)	proprotein convertase 2	0.0584	0.3087	0.3087
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Echinococcus multilocularis	serotonin receptor	0.0163	0.0708	0.0878
Echinococcus granulosus	glycoprotein Antigen 5	0.0057	0.0107	0.0089
Echinococcus granulosus	membrane bound transcription factor site 1	0.0092	0.0305	0.0287
Echinococcus multilocularis	Furin 1	0.0584	0.3087	0.3909
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Loa Loa (eye worm)	WD40 repeat protein	0.0137	0.0557	0.0557
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Schistosoma mansoni	hypothetical protein	0.0137	0.0557	0.054
Onchocerca volvulus	Deterin homolog	0.0106	0.0386	0.1371
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Toxoplasma gondii	subtilisin SUB10	0.0092	0.0305	1
Loa Loa (eye worm)	hypothetical protein	0.0363	0.1839	0.1839
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0092	0.0305	0.0287
Loa Loa (eye worm)	AGC/DMPK/ROCK protein kinase	0.0943	0.512	0.512
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0167	0.0729	0.1397
Echinococcus granulosus	rho-associated protein kinase 1	0.0304	0.1502	0.1486
Onchocerca volvulus		0.0092	0.0305	0.0741
Loa Loa (eye worm)	hypothetical protein	0.092	0.4989	0.4989
Trypanosoma brucei	subtilisin peptidase	0.0092	0.0305	0.5
Toxoplasma gondii	subtilisin SUB7	0.0092	0.0305	1
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0092	0.0305	0.5
Echinococcus multilocularis	wd40 repeat	0.0072	0.0189	0.0217
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0708	0.0708
Schistosoma mansoni	retinoblastoma binding protein	0.0072	0.0189	0.0171
Echinococcus granulosus	inhibitor of apoptosis protein	0.0106	0.0386	0.0368
Echinococcus multilocularis	enteropeptidase	0.0057	0.0107	0.0113
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.0305	0.0584
Toxoplasma gondii	subtilisin SUB6	0.0092	0.0305	1
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0092	0.0305	0.5
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0092	0.0305	0.5
Plasmodium falciparum	subtilisin-like protease 2	0.0092	0.0305	1
Loa Loa (eye worm)	hypothetical protein	0.1806	1	1
Schistosoma mansoni	hypothetical protein	0.0106	0.0386	0.0368
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0584	0.3087	0.5915
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Brugia malayi	Furin-like cysteine rich region family protein	0.0321	0.1599	0.1583
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0092	0.0305	0.5
Trichomonas vaginalis	hypothetical protein	0.0417	0.2142	0.4103
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0386	0.0386
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0305	0.0305
Echinococcus multilocularis	inhibitor of apoptosis protein	0.0106	0.0386	0.0468
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0386	0.0386
Echinococcus granulosus	protein will die slowly	0.0137	0.0557	0.054
Onchocerca volvulus		0.0106	0.0386	0.1371
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0961	0.5219	1
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Schistosoma mansoni	serine/threonine protein kinase	0.0304	0.1502	0.1486
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0092	0.0305	0.5
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.0961	0.5219	0.6625
Echinococcus granulosus	enteropeptidase	0.0057	0.0107	0.0089
Echinococcus granulosus	Mastin	0.0057	0.0107	0.0089
Loa Loa (eye worm)	subtilase	0.0092	0.0305	0.0305
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.0305	0.0584
Echinococcus multilocularis	rho associated protein kinase	0.0304	0.1502	0.1889
Trichomonas vaginalis	conserved hypothetical protein	0.0092	0.0305	0.0584
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0092	0.0305	0.0287
Toxoplasma gondii	subtilisin SUB4	0.0092	0.0305	1
Schistosoma mansoni	inhibitor of apoptosis protein	0.0106	0.0386	0.0368
Echinococcus multilocularis	neuroendocrine convertase 2	0.1429	0.7868	1
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.0106	0.0386	0.0368
Onchocerca volvulus		0.0303	0.1498	0.9972
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0092	0.0305	0.0364
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	conserved hypothetical protein	0.0417	0.2142	0.4103
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0961	0.5219	1
Toxoplasma gondii	subtilisin SUB11	0.0092	0.0305	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0163	0.0708	0.069
Onchocerca volvulus		0.0137	0.0557	0.2695
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0092	0.0305	0.0364
Trichomonas vaginalis	retinoblastoma binding protein, putative	0.0072	0.0189	0.0363
Toxoplasma gondii	subtilisin SUB1	0.0092	0.0305	1
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0092	0.0305	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0092	0.0305	0.5
Plasmodium vivax	subtilisin-like serine protease, putative	0.0092	0.0305	1
Echinococcus granulosus	wd40 repeat	0.0072	0.0189	0.0171
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0057	0.0107	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0708	0.0708
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.0492	0.2566	0.4917
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Toxoplasma gondii	subtilisin SUB2	0.0092	0.0305	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Brugia malayi	Subtilase family protein	0.0092	0.0305	0.0287
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0092	0.0305	0.5
Loa Loa (eye worm)	SPRY domain-containing protein	0.0042	0.0019	0.0019
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.0106	0.0386	0.0368
Brugia malayi	neuroendocrine convertase 1 precursor	0.1717	0.9499	0.9498
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.0492	0.2566	0.4917
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0189	0.0363
Brugia malayi	Hypothetical WD-repeat protein F21H12.1 in chromosome II	0.0072	0.0189	0.0171
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.0961	0.5219	0.521
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0092	0.0305	0.0584
Echinococcus granulosus	biogenic amine 5HT receptor	0.0163	0.0708	0.069
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.0417	0.2142	0.4103
Echinococcus granulosus	furin	0.1806	1	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0321	0.1599	0.1599
Schistosoma mansoni	hypothetical protein	0.0417	0.2142	0.2127

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 0.118 nM	Displacemnt of [3H]-8-OH-DPAT from rat hippocampal 5-hydroxytryptamine 1A receptor	ChEMBL.	9111299
Ki (binding)	= 0.118 nM	Displacemnt of [3H]-8-OH-DPAT from rat hippocampal 5-hydroxytryptamine 1A receptor	ChEMBL.	9111299
Ki (binding)	= 0.581 nM	In vitro radioligand binding assay on Dopamine receptor D2 of rat striatum using [3H]- spiperone	ChEMBL.	9111299
Ki (binding)	= 0.581 nM	In vitro radioligand binding assay on Dopamine receptor D2 of rat striatum using [3H]- spiperone	ChEMBL.	9111299
Ki (binding)	= 5.19 nM	In vitro radioligand binding assay on adrenaline Alpha-1 adrenergic receptor of rat cortex using [3H]- prazosin	ChEMBL.	9111299
Ki (binding)	= 5.19 nM	In vitro radioligand binding assay on adrenaline Alpha-1 adrenergic receptor of rat cortex using [3H]- prazosin	ChEMBL.	9111299

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: CHEMBL25215
PubChem: 10522191

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 27653