TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 484.591 | Formula: C25H36N6O4
H donors: 0 H acceptors: 3 LogP: 3.02 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCCOc1nc2c(n1CCCCN1CCN(CC1)c1ccccc1OC)c(=O)n(c(=O)n2C)C
InChi: 1S/C25H36N6O4/c1-5-18-35-24-26-22-21(23(32)28(3)25(33)27(22)2)31(24)13-9-8-12-29-14-16-30(17-15-29)19-10-6-7-11-20(19)34-4/h6-7,10-11H,5,8-9,12-18H2,1-4H3
InChiKey: SCNPNBGMTVLCGU-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Serotonin 7 (5-HT7) receptor	Starlite/ChEMBL	References
Rattus norvegicus	Serotonin 1a (5-HT1a) receptor	Starlite/ChEMBL	References
Rattus norvegicus	Serotonin 2a (5-HT2a) receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Octopamine receptor, putative	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	expressed protein	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma mansoni	biogenic amine (5HT) receptor	Get druggable targets OG5_133074	All targets in OG5_133074
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_133074	All targets in OG5_133074
Schistosoma japonicum	ko:K04153 5-hydroxytryptamine (serotonin) receptor 1A, putative	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	biogenic amine (5HT) receptor	Get druggable targets OG5_133074	All targets in OG5_133074
Echinococcus multilocularis	serotonin receptor	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
Loa Loa (eye worm)	hypothetical protein	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

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	436 aa	23.9 %
Echinococcus granulosus	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.0 %
Schistosoma mansoni	amine GPCR	Serotonin 1a (5-HT1a) receptor	422 aa	440 aa	31.6 %
Loa Loa (eye worm)	TYRA-2 protein	Serotonin 1a (5-HT1a) receptor	422 aa	491 aa	27.3 %
Echinococcus multilocularis	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.2 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Serotonin 1a (5-HT1a) receptor	422 aa	383 aa	30.5 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.4 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	24.3 %
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Serotonin 1a (5-HT1a) receptor	422 aa	444 aa	29.3 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	417 aa	21.1 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	390 aa	33.6 %
Onchocerca volvulus	Ubiquinol-cytochrome-c reductase complex assembly factor 1 homolog	Serotonin 2a (5-HT2a) receptor	471 aa	435 aa	23.0 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	433 aa	22.4 %
Loa Loa (eye worm)	hypothetical protein	Serotonin 1a (5-HT1a) receptor	422 aa	388 aa	26.5 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.6 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	407 aa	23.3 %
Onchocerca volvulus	Glycoprotein hormone beta 5 homolog	Serotonin 1a (5-HT1a) receptor	422 aa	477 aa	24.3 %
Echinococcus granulosus	alpha 1A adrenergic receptor	Serotonin 1a (5-HT1a) receptor	422 aa	452 aa	21.0 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Serotonin 2a (5-HT2a) receptor	471 aa	405 aa	25.4 %
Schistosoma japonicum	Octopamine receptor 1, putative	Serotonin 1a (5-HT1a) receptor	422 aa	424 aa	24.3 %
Echinococcus multilocularis	neuropeptides capa receptor	Serotonin 1a (5-HT1a) receptor	422 aa	430 aa	20.0 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	426 aa	29.6 %
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 %
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	Serotonin 1a (5-HT1a) receptor	422 aa	350 aa	20.6 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Serotonin 1a (5-HT1a) receptor	422 aa	448 aa	29.7 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Serotonin 1a (5-HT1a) receptor	422 aa	339 aa	23.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Giardia lamblia	NAD-dependent histone deacetylase Sir2	0.0126	0.045	0.1107
Loa Loa (eye worm)	aminopeptidase N	0.0035	0.0029	0.0024
Trypanosoma brucei	subtilisin peptidase	0.0098	0.0321	0.7791
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0098	0.0321	1
Leishmania major	subtilisin-like serine peptidase	0.0098	0.0321	1
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0098	0.0321	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0072	0.0067
Echinococcus granulosus	Furin 1	0.0541	0.2358	0.2354
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 1	0.0126	0.045	0.0559
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0035	0.0029	0.0024
Trichomonas vaginalis	cyclins, putative	0.0041	0.006	0.0098
Echinococcus multilocularis	aminopeptidase N	0.0117	0.041	0.0508
Echinococcus multilocularis	Furin 1	0.0541	0.2358	0.2956
Brugia malayi	NAD-dependent deacetylase SIRT1	0.0126	0.045	0.0446
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0098	0.0321	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.0541	0.2358	0.2354
Onchocerca volvulus		0.0117	0.041	1
Trichomonas vaginalis	conserved hypothetical protein	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0035	0.0029	0.0048
Brugia malayi	Protein kinase domain containing protein	0.0044	0.0072	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0854	0.3795	0.3792
Onchocerca volvulus		0.0076	0.0221	0.5328
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0133	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0105	0.0354	0.0349
Onchocerca volvulus		0.0044	0.0072	0.1651
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Toxoplasma gondii	subtilisin SUB10	0.0098	0.0321	1
Trichomonas vaginalis	WD repeat domain, putative	0.0065	0.017	0.0279
Brugia malayi	hypothetical protein	0.0035	0.0029	0.0024
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0098	0.0321	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0126	0.045	0.0446
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0035	0.0029	0.0024
Trichomonas vaginalis	cyclin B, putative	0.0041	0.006	0.0098
Trichomonas vaginalis	cyclin B, putative	0.0041	0.006	0.0098
Trypanosoma brucei	mitotic cyclin 6	0.0041	0.006	0.0811
Onchocerca volvulus		0.0035	0.0029	0.0595
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0098	0.0321	0.0316
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.0443	0.1908	0.314
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.0035	0.0029	0.0024
Trichomonas vaginalis	cyclins, putative	0.0041	0.006	0.0098
Loa Loa (eye worm)	hypothetical protein	0.011	0.0374	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0072	0.0067
Echinococcus granulosus	MAM	0.0044	0.0072	0.0067
Mycobacterium leprae	Possible secreted protease	0.0098	0.0321	0.5
Schistosoma mansoni	hypothetical protein	0.0443	0.1908	0.1903
Trichomonas vaginalis	cyclin B, putative	0.0041	0.006	0.0098
Schistosoma mansoni	biogenic amine (5HT) receptor	0.047	0.203	0.2026
Plasmodium falciparum	subtilisin-like protease 1	0.0098	0.0321	1
Echinococcus multilocularis	epidermal growth factor receptor	0.0249	0.1013	0.1266
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0098	0.0321	0.0316
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0098	0.0321	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0163	0.0618	0.0613
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Giardia lamblia	High cysteine membrane protein Group 2	0.0809	0.3589	1
Echinococcus granulosus	neuroendocrine convertase 2	0.1395	0.6282	0.628
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0163	0.0618	0.0613
Plasmodium falciparum	subtilisin-like protease 2	0.0098	0.0321	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0035	0.0029	0.0024
Toxoplasma gondii	subtilisin SUB11	0.0098	0.0321	1
Toxoplasma gondii	subtilisin SUB7	0.0098	0.0321	1
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0098	0.0321	0.5
Trypanosoma cruzi	cyclin 6, putative	0.0041	0.006	0.1366
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Toxoplasma gondii	subtilisin SUB1	0.0098	0.0321	1
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.0035	0.0029	0.003
Brugia malayi	celfurPC protein	0.1761	0.7963	0.7962
Brugia malayi	Peptidase family M1 containing protein	0.0035	0.0029	0.0024
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0035	0.0029	0.003
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.2205	1	1
Trichomonas vaginalis	hypothetical protein	0.0443	0.1908	0.314
Loa Loa (eye worm)	hypothetical protein	0.2205	1	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0035	0.0029	0.0024
Echinococcus multilocularis	protein will die slowly	0.0065	0.017	0.0206
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0098	0.0321	0.5
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0116	0.0404	1
Toxoplasma gondii	subtilisin SUB5	0.0098	0.0321	1
Toxoplasma gondii	subtilisin SUB6	0.0098	0.0321	1
Entamoeba histolytica	cyclin, putative	0.0041	0.006	1
Brugia malayi	neuroendocrine convertase 1 precursor	0.1395	0.6282	0.628
Plasmodium vivax	subtilisin-like serine protease, putative	0.0098	0.0321	1
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.0041	0.006	0.1724
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Giardia lamblia	Furin precursor putative serine protease	0.0443	0.1908	0.5237
Toxoplasma gondii	subtilisin SUB12	0.0098	0.0321	1
Trypanosoma cruzi	cyclin, putative	0.0041	0.006	0.1366
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0251	0.0246
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Brugia malayi	proprotein convertase 2	0.1395	0.6282	0.628
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trypanosoma cruzi	Aminopeptidase M1, putative	0.0035	0.0029	0.0604
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0126	0.045	0.0741
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0035	0.0029	0.003
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	cyclins, putative	0.0041	0.006	0.0098
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0035	0.0029	0.003
Loa Loa (eye worm)	proprotein convertase 2	0.0541	0.2358	0.2354
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Loa Loa (eye worm)	hypothetical protein	0.0041	0.006	0.0055
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Loa Loa (eye worm)	TK/ALK protein kinase	0.0044	0.0072	0.0067
Toxoplasma gondii	subtilisin SUB8	0.0098	0.0321	1
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0618	0.0613
Brugia malayi	Angiotensin-converting enzyme family protein	0.0601	0.2632	0.2629
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0035	0.0029	0.0048
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Echinococcus multilocularis	serotonin receptor	0.0163	0.0618	0.077
Echinococcus granulosus	membrane bound transcription factor site 1	0.0098	0.0321	0.0316
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.135	0.6076	0.6074
Onchocerca volvulus		0.0036	0.0035	0.0741
Echinococcus granulosus	furin	0.2205	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.0035	0.0029	0.0762
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.0035	0.0029	0.0604
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Leishmania major	aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.0035	0.0029	0.0762
Trypanosoma cruzi	CYC2-like cyclin, putative	0.0041	0.006	0.1366
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trypanosoma cruzi	aminopeptidase, putative	0.0035	0.0029	0.0604
Echinococcus multilocularis		0.1761	0.7963	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Schistosoma mansoni	hypothetical protein	0.0044	0.0072	0.0067
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0098	0.0321	0.0316
Trichomonas vaginalis	cyclins, putative	0.0041	0.006	0.0098
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.047	0.203	0.2545
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0098	0.0321	1
Echinococcus granulosus	protein will die slowly	0.0065	0.017	0.0164
Onchocerca volvulus		0.0065	0.017	0.4059
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0126	0.045	0.0741
Onchocerca volvulus		0.0044	0.0072	0.1651
Echinococcus multilocularis	MAM	0.0044	0.0072	0.0084
Loa Loa (eye worm)	peptidase family M1 containing protein	0.0095	0.0307	0.0302
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Trichomonas vaginalis	cyclin B, putative	0.0041	0.006	0.0098
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0098	0.0321	0.0396
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0098	0.0321	0.0396
Schistosoma mansoni	cyclin B	0.0041	0.006	0.0054
Toxoplasma gondii	subtilisin SUB4	0.0098	0.0321	1
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0069	0.0187	0.0182
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.135	0.6076	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.047	0.203	0.2026
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Plasmodium falciparum	subtilisin-like protease 3	0.0098	0.0321	1
Echinococcus multilocularis	serotonin receptor	0.0163	0.0618	0.077
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0126	0.045	0.0741
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0035	0.0029	0.003
Trichomonas vaginalis	conserved hypothetical protein	0.0098	0.0321	0.0528
Echinococcus granulosus	NAD dependent deacetylase sirtuin 1	0.0126	0.045	0.0445
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0048	0.0092	0.0086
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0098	0.0321	0.7924
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0098	0.0321	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	conserved hypothetical protein	0.0098	0.0321	0.0528
Loa Loa (eye worm)	subtilase	0.0098	0.0321	0.0316
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0035	0.0033	0.0028
Trypanosoma cruzi	cyclin, putative	0.0041	0.006	0.1366
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0072	0.0067
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0032	0.0016	0.001
Schistosoma mansoni	hypothetical protein	0.0044	0.0072	0.0067
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.135	0.6076	0.7628
Plasmodium vivax	subtilisin-like protease 2, putative	0.0098	0.0321	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0249	0.1013	0.1009
Schistosoma mansoni	septate junction protein	0.0032	0.0019	0.0014
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0098	0.0321	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0321	0.0316
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0041	0.006	0.0055
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Echinococcus multilocularis	neuroendocrine convertase 2	0.1395	0.6282	0.7888
Echinococcus granulosus	epidermal growth factor receptor	0.0249	0.1013	0.1008
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0541	0.2358	0.3881
Toxoplasma gondii	subtilisin SUB2	0.0098	0.0321	1
Trichomonas vaginalis	conserved hypothetical protein	0.0098	0.0321	0.0528
Loa Loa (eye worm)	endoprotease bli-4	0.2205	1	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Echinococcus granulosus	aminopeptidase N	0.0117	0.041	0.0405
Brugia malayi	Peptidase family M1 containing protein	0.0117	0.041	0.0405
Trichomonas vaginalis	conserved hypothetical protein	0.0443	0.1908	0.314
Plasmodium vivax	subtilisin-like protease 1	0.0098	0.0321	1
Onchocerca volvulus		0.0041	0.006	0.1345
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0035	0.0029	0.003
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0041	0.006	0.0055
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0116	0.0404	1
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0126	0.045	0.0741
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0116	0.0404	1
Trypanosoma cruzi	subtilisin peptidase	0.0098	0.0321	0.7924
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.135	0.6076	1
Brugia malayi	Furin-like cysteine rich region family protein	0.0249	0.1013	0.1009
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.0443	0.1908	0.314
Loa Loa (eye worm)	hypothetical protein	0.0041	0.006	0.0055
Schistosoma mansoni	hypothetical protein	0.0065	0.017	0.0164
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Echinococcus multilocularis	cyclin B	0.0041	0.006	0.0068
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Brugia malayi	hypothetical protein	0.0044	0.0072	0.0067
Loa Loa (eye worm)	WD40 repeat protein	0.0065	0.017	0.0165
Schistosoma mansoni	chromatin regulatory protein sir2	0.0126	0.045	0.0445
Onchocerca volvulus		0.0098	0.0321	0.7802
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0098	0.0321	0.5
Toxoplasma gondii	subtilisin SUB9	0.0098	0.0321	1
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0098	0.0321	0.0316
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.0443	0.1908	0.314
Trichomonas vaginalis	conserved hypothetical protein	0.0098	0.0321	0.0528
Schistosoma mansoni	furin-1 (S08 family)	0.0952	0.4245	0.4242
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0098	0.0321	0.5
Schistosoma mansoni	tyrosine kinase	0.0249	0.1013	0.1008
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0618	0.0613
Echinococcus granulosus	cyclin B	0.0041	0.006	0.0054
Brugia malayi	Will die slowly protein	0.0065	0.017	0.0165
Brugia malayi	Subtilase family protein	0.0098	0.0321	0.0316
Leishmania major	cyclin	0.0041	0.006	0.1724
Trichomonas vaginalis	cyclin A, putative	0.0041	0.006	0.0098
Loa Loa (eye worm)	angiotensin-converting enzyme family protein	0.0601	0.2632	0.2629
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0098	0.0321	0.0528

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 19 nM	Displacement of [3H]8-OH-DPAT from rat brain 5HT1A receptor	ChEMBL.	17517514
Ki (binding)	= 19 nM	Displacement of [3H]8-OH-DPAT from rat brain 5HT1A receptor	ChEMBL.	17517514
Ki (binding)	= 150 nM	Displacement of [3H]ketanserin from rat brain 5HT2A receptor	ChEMBL.	17517514
Ki (binding)	= 150 nM	Displacement of [3H]ketanserin from rat brain 5HT2A receptor	ChEMBL.	17517514
Ki (binding)	= 160 nM	Displacement of [3H]5CT from 5HT7 receptor in Wistar rat hypothalamic membrane	ChEMBL.	17517514
Ki (binding)	= 160 nM	Displacement of [3H]5CT from 5HT7 receptor in Wistar rat hypothalamic membrane	ChEMBL.	17517514

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: CHEMBL390734

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 426159