TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 448.001 | Formula: C23H34ClN5O2
H donors: 0 H acceptors: 4 LogP: 3.74 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=C1N(CCCCN2CCN(CC2)c2ncccn2)C(=O)C2C1C1CCCC2CC1.Cl
InChi: 1S/C23H33N5O2.ClH/c29-21-19-17-5-3-6-18(8-7-17)20(19)22(30)28(21)12-2-1-11-26-13-15-27(16-14-26)23-24-9-4-10-25-23;/h4,9-10,17-20H,1-3,5-8,11-16H2;1H
InChiKey: DPQXIDFINZHDHS-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

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

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	expressed 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 mansoni	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
Loa Loa (eye worm)	hypothetical protein	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
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	serotonin 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
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	417 aa	21.1 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Serotonin 1a (5-HT1a) receptor	422 aa	339 aa	23.0 %
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	Serotonin 1a (5-HT1a) receptor	422 aa	350 aa	20.6 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.4 %
Schistosoma japonicum	Octopamine receptor 1, putative	Serotonin 1a (5-HT1a) receptor	422 aa	424 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	392 aa	20.7 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	433 aa	22.4 %
Echinococcus granulosus	alpha 1A adrenergic receptor	Serotonin 1a (5-HT1a) receptor	422 aa	452 aa	21.0 %
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	436 aa	23.9 %
Schistosoma japonicum	ko:K04145 dopamine receptor D2, putative	Serotonin 1a (5-HT1a) receptor	422 aa	410 aa	27.8 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	426 aa	29.6 %
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 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Serotonin 1a (5-HT1a) receptor	422 aa	448 aa	29.7 %
Echinococcus granulosus	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.0 %
Loa Loa (eye worm)	hypothetical protein	Serotonin 1a (5-HT1a) receptor	422 aa	388 aa	26.5 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Serotonin 1a (5-HT1a) receptor	422 aa	383 aa	30.5 %
Echinococcus multilocularis	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.2 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	390 aa	33.6 %
Onchocerca volvulus	Glycoprotein hormone beta 5 homolog	Serotonin 1a (5-HT1a) receptor	422 aa	477 aa	24.3 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.6 %
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	407 aa	23.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.07	0.2824	0.2824
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0293	0.116	0.116
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0036	0.0104	0.0104
Trypanosoma cruzi	cysteine peptidase, putative	0.07	0.2824	0.1883
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0293	0.116	0.206
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0293	0.116	0.116
Schistosoma mansoni	cathepsin s	0.0406	0.1622	0.1622
Onchocerca volvulus	Cathepsin L homolog	0.1295	0.5265	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.1295	0.5265	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0036	0.0104	0.0104
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2451	1	1
Schistosoma mansoni	cathepsin S (C01 family)	0.0293	0.116	0.116
Onchocerca volvulus		0.0889	0.3601	0.5946
Schistosoma mansoni	cathepsin C	0.0293	0.116	0.116
Onchocerca volvulus		0.1295	0.5265	1
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Echinococcus multilocularis	cathepsin b	0.2451	1	1
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0036	0.0104	0.0104
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.07	0.2824	0.5279
Echinococcus granulosus	cathepsin L	0.07	0.2824	0.2824
Echinococcus multilocularis	serotonin receptor	0.015	0.0572	0.0572
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0293	0.116	0.206
Loa Loa (eye worm)	hypothetical protein	0.0889	0.3601	0.3601
Echinococcus granulosus	cathepsin l cysteine peptidase	0.1295	0.5265	0.5265
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0961	0.3894	0.3093
Plasmodium vivax	unspecified product	0.07	0.2824	0.4054
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Trypanosoma cruzi	cysteine proteinase, putative	0.07	0.2824	0.1883
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Loa Loa (eye worm)	ctsf protein	0.1295	0.5265	0.5265
Leishmania major	cysteine peptidase A (CPA)	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Trypanosoma cruzi	cysteine proteinase, putative	0.07	0.2824	0.1883
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Entamoeba histolytica	cysteine proteinase 2	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1295	0.5265	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.015	0.0572	0.0572
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0406	0.1622	0.1622
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0293	0.116	0.116
Echinococcus multilocularis	cysteine protease	0.1295	0.5265	0.5265
Giardia lamblia	Cathepsin B precursor	0.0961	0.3894	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Echinococcus granulosus	cathepsin b	0.2451	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2451	1	1
Onchocerca volvulus		0.1295	0.5265	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.1295	0.5265	0.5265
Loa Loa (eye worm)	hypothetical protein	0.015	0.0572	0.0572
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0293	0.116	0.206
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0293	0.116	0.206
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0889	0.3601	0.2761
Brugia malayi	cathepsin F-like cysteine proteinase	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Loa Loa (eye worm)	cathepsin B	0.0961	0.3894	0.3894
Schistosoma mansoni	cathepsin F (C01 family)	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0293	0.116	0.206
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0406	0.1622	0.1622
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Brugia malayi	Papain family cysteine protease containing protein	0.07	0.2824	0.2824
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0293	0.116	0.116
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Giardia lamblia	Cathepsin B precursor	0.0961	0.3894	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0889	0.3601	0.3601
Echinococcus granulosus	biogenic amine 5HT receptor	0.015	0.0572	0.0572
Trypanosoma cruzi	cysteine peptidase, putative	0.0406	0.1622	0.0523
Brugia malayi	Cathepsin L-like precursor	0.0889	0.3601	0.3601
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0889	0.3601	0.6781
Onchocerca volvulus	Cathepsin L homolog	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0085	0.0085
Onchocerca volvulus		0.1295	0.5265	1
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Giardia lamblia	Cathepsin B precursor	0.0961	0.3894	1
Echinococcus multilocularis	cathepsin L	0.07	0.2824	0.2824
Echinococcus granulosus	cathepsin L cysteine protease	0.07	0.2824	0.2824
Echinococcus multilocularis	serotonin receptor	0.015	0.0572	0.0572
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0889	0.3601	0.3601
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0293	0.116	0.116
Loa Loa (eye worm)	hypothetical protein	0.0406	0.1622	0.1622
Brugia malayi	cathepsin L precursor	0.0293	0.116	0.116
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0961	0.3894	0.4382
Trypanosoma cruzi	cruzipain precursor, putative	0.1295	0.5265	0.4644
Echinococcus multilocularis	cysteine protease	0.1295	0.5265	0.5265
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Echinococcus granulosus	cathepsin L cysteine proteinase	0.1295	0.5265	0.5265
Brugia malayi	Papain family cysteine protease containing protein	0.07	0.2824	0.2824
Echinococcus multilocularis	cathepsin L cysteine protease	0.1295	0.5265	0.5265
Onchocerca volvulus		0.1295	0.5265	1
Trypanosoma cruzi	cysteine peptidase, putative	0.1295	0.5265	0.4644
Plasmodium vivax	vivapain-3	0.07	0.2824	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0889	0.3601	0.5946
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Toxoplasma gondii	cathepsin B	0.0961	0.3894	0.666
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Plasmodium vivax	unspecified product	0.0406	0.1622	0.1125
Trypanosoma cruzi	cysteine peptidase, putative	0.1295	0.5265	0.4644
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Brugia malayi	Papain family cysteine protease containing protein	0.0293	0.116	0.116
Echinococcus granulosus	cathepsin l1	0.1295	0.5265	0.5265
Trichomonas vaginalis	conserved hypothetical protein	0.0293	0.116	0.206
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.1295	0.5265	0.5265
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0961	0.3894	0.3894
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0293	0.116	0.206
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.07	0.2824	0.1883
Entamoeba histolytica	cysteine proteinase, putative	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Echinococcus multilocularis	cathepsin b	0.2451	1	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.1295	0.5265	1
Plasmodium vivax	vivapain-2	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Onchocerca volvulus		0.1295	0.5265	1
Brugia malayi	Cathepsin L-like precursor	0.0889	0.3601	0.3601
Trypanosoma cruzi	cysteine peptidase, putative	0.1295	0.5265	0.4644
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Echinococcus granulosus	cathepsin l1	0.0889	0.3601	0.3601
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0293	0.116	0.116
Entamoeba histolytica	cysteine proteinase, putative	0.07	0.2824	0.4054
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0293	0.116	0.116
Brugia malayi	cathepsin F-like cysteine proteinase	0.0406	0.1622	0.1622
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.07	0.2824	0.5279
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0293	0.116	0.116
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0293	0.116	0.206
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0293	0.116	0.116
Schistosoma mansoni	voltage-gated potassium channel	0.0039	0.0118	0.0118
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0406	0.1622	0.0523
Plasmodium vivax	vivapain-2	0.1295	0.5265	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2451	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Echinococcus granulosus	cathepsin b	0.2451	1	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0293	0.116	0.116
Plasmodium falciparum	cysteine proteinase falcipain 1	0.07	0.2824	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0889	0.3601	0.3601
Loa Loa (eye worm)	hypothetical protein	0.0889	0.3601	0.3601
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.07	0.2824	0.2824
Brugia malayi	fibroinase precursor	0.0293	0.116	0.116
Trypanosoma cruzi	cysteine protease, putative	0.07	0.2824	0.1883
Brugia malayi	cathepsin L-like precursor	0.0889	0.3601	0.3601
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Onchocerca volvulus		0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.0406	0.1622	0.1622
Brugia malayi	Papain family cysteine protease containing protein	0.0293	0.116	0.116
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Echinococcus granulosus	cathepsin L	0.0293	0.116	0.116
Plasmodium falciparum	cysteine proteinase falcipain 3	0.1295	0.5265	1
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0293	0.116	0.206
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0293	0.116	0.116
Brugia malayi	Cathepsin L-like precursor	0.0406	0.1622	0.1622
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.07	0.2824	0.4054
Schistosoma mansoni	cathepsin B (C01 family)	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Trichomonas vaginalis	conserved hypothetical protein	0.0293	0.116	0.206
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0293	0.116	0.116
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0293	0.116	0.206
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Loa Loa (eye worm)	fibroinase	0.1295	0.5265	0.5265
Loa Loa (eye worm)	hypothetical protein	0.015	0.0572	0.0572
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Toxoplasma gondii	cathepsin CPL	0.1295	0.5265	1
Loa Loa (eye worm)	cysteine protease	0.1295	0.5265	0.5265
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Brugia malayi	Papain family cysteine protease containing protein	0.0293	0.116	0.116
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Echinococcus granulosus	cysteine protease	0.07	0.2824	0.2824
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0293	0.116	0.116
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.2451	1	1
Plasmodium vivax	vivapain-1	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0961	0.3894	0.7348
Onchocerca volvulus	Cathepsin F homolog	0.1295	0.5265	1
Brugia malayi	Papain family cysteine protease containing protein	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0036	0.0104	0.0104
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1295	0.5265	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.07	0.2824	0.2824
Entamoeba histolytica	cysteine protease, putative	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.0406	0.1622	0.1622
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Entamoeba histolytica	cysteine proteinase, putative	0.07	0.2824	0.4054
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Echinococcus multilocularis	cathepsin L	0.0293	0.116	0.116
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Onchocerca volvulus		0.1295	0.5265	1
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.07	0.2824	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Entamoeba histolytica	cysteine proteinase, putative	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0889	0.3601	0.6781
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0293	0.116	0.206
Schistosoma mansoni	voltage-gated potassium channel	0.0039	0.0118	0.0118
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1295	0.5265	1
Entamoeba histolytica	cysteine proteinase, putative	0.1295	0.5265	1
Trypanosoma cruzi	cysteine peptidase, putative	0.1295	0.5265	0.4644
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.2451	1	1
Loa Loa (eye worm)	hypothetical protein	0.0293	0.116	0.116
Brugia malayi	Cathepsin L-like precursor	0.1295	0.5265	0.5265
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1295	0.5265	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0293	0.116	0.206
Entamoeba histolytica	cysteine protease, putative	0.07	0.2824	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.1295	0.5265	0.5265
Leishmania major	cathepsin L-like protease	0.1295	0.5265	1
Loa Loa (eye worm)	hypothetical protein	0.2451	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0293	0.116	0.206

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	= 74 %	In vitro inhibition of [3H]-spiperone binding to dopamine receptor D2 from rat brain limbic tissue at 1 microM.	ChEMBL.	2898533
Ki (binding)	= 5 nM	In vitro inhibition of [3H]-spiperone binding to 5-hydroxytryptamine 1A receptor from rat hippocampal tissue.	ChEMBL.	2898533

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: CHEMBL1202527

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 940610