TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 381.428 | Formula: C20H23N5O3
H donors: 1 H acceptors: 4 LogP: 3.13 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1cc(CCNC(=O)c2cccc(c2)n2cnnn2)ccc1OCC
InChi: 1S/C20H23N5O3/c1-3-27-18-9-8-15(12-19(18)28-4-2)10-11-21-20(26)16-6-5-7-17(13-16)25-14-22-23-24-25/h5-9,12-14H,3-4,10-11H2,1-2H3,(H,21,26)
InChiKey: IWPSMPVAVKHNLU-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
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	ataxin 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Plasmodium falciparum	cyclin 1	0.0032	0.0419	0.1696
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0028	0.0359	0.5
Toxoplasma gondii	cyclin, N-terminal domain-containing protein	0.0032	0.0419	0.2305
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Echinococcus granulosus	cyclin B	0.021	0.3176	0.3166
Plasmodium falciparum	cyclin	0.0131	0.1959	1
Trichomonas vaginalis	cyclins, putative	0.021	0.3176	0.5167
Toxoplasma gondii	subtilisin SUB1	0.0028	0.0359	0.1869
Echinococcus multilocularis	cyclin B	0.021	0.3176	0.3933
Brugia malayi	neuroendocrine convertase 1 precursor	0.0409	0.6258	0.6249
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	cyclin A, putative	0.0032	0.0419	0.0529
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Echinococcus multilocularis	neuroendocrine convertase 2	0.0409	0.6258	0.7767
Echinococcus granulosus	furin	0.0652	1	1
Loa Loa (eye worm)	proprotein convertase 2	0.0154	0.2307	0.2307
Trypanosoma cruzi	hypothetical protein, conserved	0.0032	0.0419	0.0383
Schistosoma mansoni	serine/threonine protein kinase	0.0025	0.0309	0.0294
Brugia malayi	hypothetical protein	0.0111	0.1641	0.1622
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.0396	0.605	0.6044
Echinococcus granulosus	cyclins	0.0131	0.1959	0.1947
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0028	0.0359	0.0345
Brugia malayi	hypothetical protein	0.0032	0.0419	0.0396
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0028	0.0359	0.0428
Giardia lamblia	Cyclin B-like protein	0.0032	0.0419	0.0882
Leishmania major	cyclin 9, putative	0.0032	0.0419	0.0383
Plasmodium vivax	cyclin dependent kinase binding protein, putative	0.0032	0.0419	0.3273
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0783	0.0769
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0028	0.0359	0.0345
Leishmania major	cyclin	0.021	0.3176	1
Loa Loa (eye worm)	ribosomal RNA methyltransferase	0.0011	0.0104	0.0104
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0783	0.0955
Schistosoma mansoni	furin-1 (S08 family)	0.0283	0.4309	0.4301
Echinococcus granulosus	epidermal growth factor receptor	0.0073	0.105	0.1037
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Echinococcus multilocularis	cyclin	0.0032	0.0419	0.0502
Entamoeba histolytica	cyclin, putative	0.0131	0.1959	0.6038
Brugia malayi	cell division control protein 2 homolog	0.0025	0.0309	0.0286
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Giardia lamblia	Kinase, CMGC CDK	0.0025	0.0309	0.0574
Loa Loa (eye worm)	hypothetical protein	0.0024	0.03	0.03
Trypanosoma cruzi	arginine N-methyltransferase, type I	0.004	0.0546	0.0827
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0025	0.0309	0.0309
Trypanosoma cruzi	mitotic cyclin, putative	0.0032	0.0419	0.0383
Trichomonas vaginalis	cyclins, putative	0.0131	0.1959	0.312
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.0396	0.605	0.7509
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0028	0.0359	0.0336
Schistosoma mansoni	cell division protein ftsj	0.0011	0.0104	0.0089
Trichomonas vaginalis	cyclin B, putative	0.0032	0.0419	0.0529
Echinococcus multilocularis	protein arginine N methyltransferase 7	0.004	0.0546	0.0661
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0018	0.0201	0.0178
Trichomonas vaginalis	cyclin B3, putative	0.0131	0.1959	0.312
Onchocerca volvulus		0.003	0.04	0.0963
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.0074	0.1065	0.1616
Leishmania major	arginine N-methyltransferase, type I	0.004	0.0546	0.0827
Schistosoma mansoni	hypothetical protein	0.0032	0.0419	0.0404
Leishmania major	mitotic cyclin, putative	0.0032	0.0419	0.0383
Trypanosoma cruzi	mitotic cyclin, putative	0.0032	0.0419	0.0383
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.004	0.0546	0.0743
Schistosoma mansoni	hypothetical protein	0.0014	0.014	0.0125
Echinococcus granulosus	cyclin y	0.0032	0.0419	0.0404
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.0126	0.1877	0.2982
Plasmodium vivax	subtilisin-like protease 2, putative	0.0028	0.0359	0.2654
Echinococcus granulosus	neuroendocrine convertase 2	0.0409	0.6258	0.6252
Trypanosoma cruzi	cyclin 6, putative	0.021	0.3176	1
Echinococcus granulosus	cyclin	0.0032	0.0419	0.0404
Toxoplasma gondii	subtilisin SUB9	0.0028	0.0359	0.1869
Brugia malayi	Cyclin, N-terminal domain containing protein	0.021	0.3176	0.316
Mycobacterium leprae	Possible secreted protease	0.0028	0.0359	0.5
Loa Loa (eye worm)	hypothetical protein	0.003	0.0399	0.0399
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0028	0.0359	0.083
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0236	0.3571	0.3571
Leishmania major	arginine N-methyltransferase, type III, putative;with=GeneDB:Tb927.7.5490	0.004	0.0546	0.0827
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Echinococcus multilocularis	protein arginine N methyltransferase 8	0.0074	0.1065	0.1307
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0028	0.0359	0.0176
Schistosoma mansoni	protein arginine N-methyltransferase 1	0.0074	0.1065	0.1052
Trypanosoma cruzi	arginine N-methyltransferase, putative	0.0111	0.1641	0.4648
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Brugia malayi	ribosomal RNA methyltransferase	0.0011	0.0104	0.0081
Echinococcus multilocularis	cyclin dependent kinase 1	0.0025	0.0309	0.0366
Plasmodium vivax	cyclin homologue, putative	0.0032	0.0419	0.3273
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0028	0.0359	0.0345
Echinococcus multilocularis	cyclin y	0.0032	0.0419	0.0502
Echinococcus multilocularis	cyclin dependent kinase 1	0.0025	0.0309	0.0366
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0399	0.1591
Echinococcus multilocularis	cyclin G2	0.0032	0.0419	0.0502
Trichomonas vaginalis	cyclin B, putative	0.021	0.3176	0.5167
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trypanosoma brucei	cyclin dependent kinase-binding protein, putative	0.0032	0.0419	0.1024
Giardia lamblia	Hypothetical protein	0.0032	0.0419	0.0882
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0783	0.0761
Toxoplasma gondii	subtilisin SUB12	0.0028	0.0359	0.1869
Schistosoma mansoni	protein kinase	0.0021	0.0247	0.0233
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0028	0.0359	0.5
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Entamoeba histolytica	cyclin, putative	0.021	0.3176	1
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Echinococcus multilocularis	rrna methyltransferase 3	0.0011	0.0104	0.0111
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0359	0.0429
Trypanosoma brucei	cdc2-related kinase 3	0.0025	0.0309	0.0666
Echinococcus granulosus	cyclins	0.0131	0.1959	0.1947
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Giardia lamblia	Kinase, CMGC CDK	0.0025	0.0309	0.0574
Trypanosoma brucei	Protein arginine N-methyltransferase 1 catalytic subunit	0.0111	0.1641	0.5005
Giardia lamblia	Furin precursor putative serine protease	0.0126	0.1877	0.497
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0131	0.1959	0.2419
Trypanosoma cruzi	cyclin, putative	0.021	0.3176	1
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1146	0.1146
Trichomonas vaginalis	cyclin B, putative	0.0131	0.1959	0.312
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0028	0.0359	0.0345
Plasmodium falciparum	protein arginine N-methyltransferase 1	0.0074	0.1065	0.5182
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0028	0.0359	0.5
Echinococcus granulosus	membrane bound transcription factor site 1	0.0028	0.0359	0.0345
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0359	0.0429
Plasmodium vivax	protein arginine N-methyltransferase 1, putative	0.0074	0.1065	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0399	0.0316
Entamoeba histolytica	hypothetical protein	0.0032	0.0419	0.1024
Trichomonas vaginalis	cyclin B, putative	0.021	0.3176	0.5167
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0419	0.0419
Toxoplasma gondii	cyclin dependent kinase binding protein	0.0032	0.0419	0.2305
Schistosoma mansoni	cyclin B	0.021	0.3176	0.3166
Echinococcus multilocularis	protein arginine methyltransferase	0.0074	0.1065	0.1307
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Entamoeba histolytica	cyclin C, putative	0.0032	0.0419	0.1024
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0028	0.0359	0.5
Schistosoma mansoni	hypothetical protein	0.0032	0.0419	0.0404
Trichomonas vaginalis	CMGC family protein kinase	0.0025	0.0309	0.0344
Echinococcus granulosus	Cyclin L1	0.0032	0.0419	0.0404
Schistosoma mansoni	cyclin l	0.0032	0.0419	0.0404
Echinococcus granulosus	protein arginine N methyltransferase 8	0.0074	0.1065	0.1052
Giardia lamblia	Cyclin A	0.0131	0.1959	0.52
Trichomonas vaginalis	cyclin B3, putative	0.0032	0.0419	0.0529
Echinococcus granulosus	cyclins	0.0131	0.1959	0.1947
Echinococcus multilocularis	cyclin k	0.0032	0.0419	0.0502
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.0071	0.1024	0.1548
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.0689	0.0675
Schistosoma mansoni	cyclin k	0.0032	0.0419	0.0404
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Toxoplasma gondii	histone arginine methyltransferase PRMT4/CARM1	0.004	0.0546	0.3237
Toxoplasma gondii	histone arginine methyltransferase PRMT3	0.004	0.0546	0.3237
Echinococcus granulosus	cyclin G2	0.0032	0.0419	0.0404
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	cyclin B, putative	0.021	0.3176	0.5167
Trichomonas vaginalis	cyclins, putative	0.021	0.3176	0.5167
Trichomonas vaginalis	cyclins, putative	0.011	0.1636	0.2576
Plasmodium falciparum	subtilisin-like protease 2	0.0028	0.0359	0.1375
Echinococcus multilocularis	Furin 1	0.0154	0.2307	0.2852
Giardia lamblia	Hypothetical protein	0.0032	0.0419	0.0882
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Trypanosoma brucei	cyclin 9	0.0032	0.0419	0.1024
Entamoeba histolytica	cyclin family protein	0.0131	0.1959	0.6038
Echinococcus granulosus	protein arginine N methyltransferase 7	0.004	0.0546	0.0532
Echinococcus multilocularis	cdk5 and abl1 enzyme substrate 1	0.0032	0.0419	0.0502
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0028	0.0359	0.5
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0.0399	0.3071
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0014	0.014	0.0155
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Brugia malayi	Cyclin C	0.0032	0.0419	0.0396
Schistosoma mansoni	protein arginine n-methyltransferase	0.004	0.0546	0.0532
Schistosoma mansoni	proteasome subunit alpha 1 (T01 family)	0.0032	0.0419	0.0404
Echinococcus multilocularis	epidermal growth factor receptor	0.0073	0.105	0.1288
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Toxoplasma gondii	cyclin domain protein, cyclin H family protein	0.0032	0.0419	0.2305
Echinococcus granulosus	cyclin A3 4	0.0032	0.0419	0.0404
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0028	0.0359	0.5
Plasmodium falciparum	protein kinase 5	0.0025	0.0309	0.1103
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.0074	0.1065	0.1616
Schistosoma mansoni	protein arginine N-methyltransferase 1	0.0071	0.1024	0.1011
Plasmodium vivax	subtilisin-like protease 1	0.0028	0.0359	0.2654
Toxoplasma gondii	subtilisin SUB5	0.0028	0.0359	0.1869
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0783	0.0769
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0028	0.0359	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Entamoeba histolytica	cyclin, domain containing protein	0.0032	0.0419	0.1024
Brugia malayi	hypothetical protein	0.0032	0.0419	0.0396
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0783	0.0769
Trypanosoma cruzi	arginine N-methyltransferase, putative	0.0111	0.1641	0.4648
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase subunit type II alpha	0.0018	0.0201	0.0201
Brugia malayi	hypothetical protein	0.002	0.0232	0.0209
Trypanosoma brucei	RNA helicase, putative	0.0034	0.0453	0.1137
Trichomonas vaginalis	hypothetical protein	0.0126	0.1877	0.2982
Echinococcus granulosus	cyclin dependent kinase 5	0.0025	0.0309	0.0294
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0399	0.1591
Entamoeba histolytica	hypothetical protein	0.0111	0.1641	0.5005
Plasmodium falciparum	subtilisin-like protease 1	0.0028	0.0359	0.1375
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Echinococcus granulosus	potassium voltage gated channel protein	0.0049	0.0689	0.0675
Echinococcus multilocularis	potassium voltage gated channel protein	0.0049	0.0689	0.0839
Leishmania major	mitotic cyclin, putative	0.0032	0.0419	0.0383
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0419	0.0529
Onchocerca volvulus		0.0032	0.0419	0.1024
Brugia malayi	rRNA methyltransferase	0.0011	0.0104	0.0081
Echinococcus multilocularis	cyclin B3 1	0.0131	0.1959	0.2419
Giardia lamblia	High cysteine membrane protein Group 2	0.0242	0.3671	1
Schistosoma mansoni	cyclins	0.0131	0.1959	0.1947
Echinococcus granulosus	cyclin t1	0.0032	0.0419	0.0404
Echinococcus granulosus	histone arginine methyltransferase CARMER	0.004	0.0546	0.0532
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0028	0.0359	0.5
Trichomonas vaginalis	CMGC family protein kinase	0.0025	0.0309	0.0344
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0028	0.0359	0.0336
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus multilocularis	potassium voltage gated channel subfamily A	0.0047	0.0656	0.0798
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Giardia lamblia	Hypothetical protein	0.0131	0.1959	0.52
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0014	0.014	0.0125
Entamoeba histolytica	arginine N-methyltransferase 1, putative	0.004	0.0546	0.1438
Trichomonas vaginalis	cyclin A, putative	0.021	0.3176	0.5167
Schistosoma mansoni	Cyclin fold protein	0.0032	0.0419	0.0404
Echinococcus granulosus	cyclin dependent kinase 1	0.0025	0.0309	0.0294
Loa Loa (eye worm)	cyclin C	0.0032	0.0419	0.0419
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Toxoplasma gondii	cyclin 4, putative	0.0032	0.0419	0.2305
Schistosoma mansoni	ribosomal RNA methyltransferase	0.0011	0.0104	0.0089
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.0126	0.1877	0.2982
Trypanosoma cruzi	cyclin, putative	0.021	0.3176	1
Trypanosoma brucei	protein arginine n-methyltransferase 7	0.004	0.0546	0.1438
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0028	0.0359	0.0428
Trypanosoma cruzi	protein arginine n-methyltransferase 7	0.004	0.0546	0.0827
Brugia malayi	proprotein convertase 2	0.0409	0.6258	0.6249
Onchocerca volvulus	Protein CNPPD1 homolog	0.0032	0.0419	0.1024
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Loa Loa (eye worm)	subtilase	0.0028	0.0359	0.0359
Entamoeba histolytica	cyclin family protein	0.0131	0.1959	0.6038
Trichomonas vaginalis	cyclin B, putative	0.021	0.3176	0.5167
Echinococcus multilocularis		0.0525	0.8052	1
Plasmodium falciparum	cyclin dependent kinase binding protein, putative	0.0032	0.0419	0.1696
Giardia lamblia	Cyclin fold protein 1, putative	0.0032	0.0419	0.0882
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0419	0.0419
Loa Loa (eye worm)	hypothetical protein	0.021	0.3176	0.3176
Toxoplasma gondii	subtilisin SUB11	0.0028	0.0359	0.1869
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0689	0.0689
Toxoplasma gondii	subtilisin SUB2	0.0028	0.0359	0.1869
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0419	0.0529
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0021	0.0247	0.0289
Plasmodium falciparum	subtilisin-like protease 3	0.0028	0.0359	0.1375
Trichomonas vaginalis	CMGC family protein kinase	0.0025	0.0309	0.0344
Trypanosoma cruzi	arginine N-methyltransferase, type I	0.004	0.0546	0.0827
Brugia malayi	Furin-like cysteine rich region family protein	0.0073	0.105	0.1029
Echinococcus granulosus	protein arginine methyltransferase	0.0074	0.1065	0.1052
Onchocerca volvulus	Cyclin L homolog	0.0032	0.0419	0.1024
Echinococcus granulosus	putative ribosomal RNA methyltransferase/cell division FtsJ protein	0.0011	0.0104	0.0089
Echinococcus multilocularis	cyclin dependent kinase	0.0025	0.0309	0.0366
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0028	0.0359	0.0176
Plasmodium vivax	hypothetical protein, conserved	0.0032	0.0419	0.3273
Schistosoma mansoni	hypothetical protein	0.004	0.0546	0.0532
Echinococcus granulosus	cyclin dependent kinase	0.0025	0.0309	0.0294
Echinococcus granulosus	cyclin B3 1	0.0131	0.1959	0.1947
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0359	0.0429
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0028	0.0359	0.0176
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Plasmodium vivax	subtilisin-like serine protease, putative	0.0028	0.0359	0.2654
Echinococcus granulosus	cyclins	0.0131	0.1959	0.1947
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Loa Loa (eye worm)	hypothetical protein	0.0652	1	1
Trichomonas vaginalis	cyclins, putative	0.021	0.3176	0.5167
Echinococcus multilocularis	cyclin G2	0.0032	0.0419	0.0502
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.0689	0.0675
Trypanosoma cruzi	cyclin 9, putative	0.0032	0.0419	0.0383
Echinococcus granulosus	cyclin G2	0.0032	0.0419	0.0404
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus granulosus	cdk5 and abl1 enzyme substrate 1	0.0032	0.0419	0.0404
Echinococcus granulosus	cyclin b3	0.0131	0.1959	0.1947
Echinococcus multilocularis	Cyclin L1	0.0032	0.0419	0.0502
Plasmodium vivax	cyclin 4, putative	0.0032	0.0419	0.3273
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Brugia malayi	follicle stimulating hormone receptor	0.0236	0.3571	0.3556
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus granulosus	potassium voltage gated channel subfamily A	0.0049	0.0689	0.0675
Loa Loa (eye worm)	endoprotease bli-4	0.0652	1	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus granulosus	cyclins	0.0131	0.1959	0.1947
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.0154	0.2307	0.2296
Trypanosoma cruzi	CYC2-like cyclin, putative	0.021	0.3176	1
Trichomonas vaginalis	cyclins, putative	0.0032	0.0419	0.0529
Echinococcus granulosus	cyclin y	0.0032	0.0419	0.0404
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0783	0.0769
Loa Loa (eye worm)	protein arginine N-methyltransferase	0.004	0.0546	0.0546
Trypanosoma brucei	cdc2-related kinase 1	0.0025	0.0309	0.0666
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0025	0.0309	0.0309
Toxoplasma gondii	subtilisin SUB7	0.0028	0.0359	0.1869
Schistosoma mansoni	hypothetical protein	0.0126	0.1877	0.1865
Trichomonas vaginalis	cyclins, putative	0.021	0.3176	0.5167
Entamoeba histolytica	cyclin, domain containing protein	0.0032	0.0419	0.1024
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0032	0.0419	0.1696
Trichomonas vaginalis	cyclin D, putative	0.0032	0.0419	0.0529
Brugia malayi	Carm1-pending protein	0.004	0.0546	0.0523
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0025	0.0309	0.0294
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.004	0.0546	0.0743
Trypanosoma brucei	mitotic cyclin 6	0.021	0.3176	1
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0131	0.1959	0.1947
Leishmania major	arginine N-methyltransferase-like protein	0.0071	0.1024	0.2496
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.021	0.3176	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0399	0.0316
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0073	0.105	0.105
Schistosoma mansoni	protein arginine N-methyltransferase 1	0.0074	0.1065	0.1052
Toxoplasma gondii	subtilisin SUB4	0.0028	0.0359	0.1869
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0104	0.0104
Toxoplasma gondii	subtilisin SUB6	0.0028	0.0359	0.1869
Schistosoma mansoni	tyrosine kinase	0.0073	0.105	0.1037
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Schistosoma mansoni	serine/threonine protein kinase	0.0025	0.0309	0.0294
Toxoplasma gondii	hypothetical protein	0.0032	0.0419	0.2305
Echinococcus multilocularis	cyclin A3 4	0.0032	0.0419	0.0502
Schistosoma mansoni	cyclin G	0.0032	0.0419	0.0404
Brugia malayi	cyclin fold protein 1 variant b	0.0032	0.0419	0.0396
Toxoplasma gondii	subtilisin SUB10	0.0028	0.0359	0.1869
Echinococcus granulosus	oligomeric golgi complex subunit 3	0.0032	0.0419	0.0404
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0396	0.605	1
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0028	0.0359	0.0345
Entamoeba histolytica	cell division protein kinase 2, putative	0.0025	0.0309	0.0666
Loa Loa (eye worm)	CYL-1 protein	0.0032	0.0419	0.0419
Plasmodium vivax	protein kinase Crk2	0.0025	0.0309	0.2129
Loa Loa (eye worm)	hypothetical protein	0.021	0.3176	0.3176
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Echinococcus granulosus	methyltransferase protein 5	0.004	0.0546	0.0532
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0652	1	1
Onchocerca volvulus		0.021	0.3176	1
Trichomonas vaginalis	cyclins, putative	0.0032	0.0419	0.0529
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0025	0.0309	0.1499
Echinococcus multilocularis	oligomeric golgi complex subunit 3	0.0032	0.0419	0.0502
Echinococcus multilocularis	ribosomal RNA large subunit methyltransferase	0.0011	0.0104	0.0111
Echinococcus granulosus	cyclin k	0.0032	0.0419	0.0404
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0396	0.605	1
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Trypanosoma brucei	PAB1-binding protein , putative	0.003	0.0399	0.0961
Echinococcus granulosus	G1:S specific cyclin D1	0.0032	0.0419	0.0404
Loa Loa (eye worm)	hypothetical protein	0.0256	0.3879	0.3879
Trypanosoma cruzi	subtilisin peptidase	0.0028	0.0359	0.0176
Trichomonas vaginalis	cyclin B, putative	0.0032	0.0419	0.0529
Leishmania major	subtilisin-like serine peptidase	0.0028	0.0359	0.0176
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0131	0.1959	0.194
Entamoeba histolytica	cell division protein kinase 2, putative	0.0025	0.0309	0.0666
Schistosoma mansoni	protein kinase	0.0021	0.0247	0.0233
Trypanosoma brucei	mitotic cyclin	0.0032	0.0419	0.1024
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus multilocularis	cyclin b3	0.0131	0.1959	0.2419
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0359	0.0359
Toxoplasma gondii	subtilisin SUB8	0.0028	0.0359	0.1869
Echinococcus multilocularis	cyclins	0.0131	0.1959	0.2419
Toxoplasma gondii	bicoid-interacting protein BIN3	0.004	0.0546	0.3237
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0783	0.0783
Schistosoma mansoni	g1/s-specific cyclin C	0.0032	0.0419	0.0404
Brugia malayi	celfurPC protein	0.0525	0.8052	0.8047
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Loa Loa (eye worm)	cyclin fold protein 1 variant b	0.0032	0.0419	0.0419
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0028	0.0359	0.5
Echinococcus multilocularis	histone arginine methyltransferase CARMER	0.004	0.0546	0.0661
Trypanosoma cruzi	arginine N-methyltransferase, type III	0.004	0.0546	0.0827
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus multilocularis	G1:S specific cyclin D1	0.0032	0.0419	0.0502
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Schistosoma mansoni	cyclin G2	0.0032	0.0419	0.0404
Schistosoma mansoni	protein kinase	0.0021	0.0247	0.0233
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0783	0.0955
Brugia malayi	Cyclin, N-terminal domain containing protein	0.021	0.3176	0.316
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0051	0.0051
Echinococcus granulosus	rrna methyltransferase 3	0.0011	0.0104	0.0089
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0359	0.0429
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Giardia lamblia	G2/mitotic-specific cyclin B	0.021	0.3176	0.8612
Echinococcus multilocularis	cyclin t1	0.0032	0.0419	0.0502
Toxoplasma gondii	LsmAD domain-containing protein	0.003	0.0399	0.2163
Trypanosoma brucei	cyclin 3	0.0032	0.0419	0.1024
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0032	0.0419	0.0396
Schistosoma mansoni	cyclin B3	0.0131	0.1959	0.1947
Trichomonas vaginalis	protein arginine N-methyltransferase, putative	0.004	0.0546	0.0743
Onchocerca volvulus	Cyclin L homolog	0.0032	0.0419	0.1024
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0021	0.0247	0.0233
Schistosoma mansoni	hypothetical protein	0.0034	0.0453	0.0439
Leishmania major	hypothetical protein, conserved	0.003	0.0399	0.0316
Trichomonas vaginalis	cyclin D, putative	0.0131	0.1959	0.312
Trichomonas vaginalis	conserved hypothetical protein	0.0131	0.1959	0.312
Loa Loa (eye worm)	hypothetical protein	0.0111	0.1641	0.1641
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0419	0.0529
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.0126	0.1877	0.2982
Schistosoma mansoni	cyclin d	0.0032	0.0419	0.0404
Loa Loa (eye worm)	Carm1-pending protein	0.004	0.0546	0.0546
Trichomonas vaginalis	cyclin B3, putative	0.0032	0.0419	0.0529
Treponema pallidum	cell division protein (ftsJ)	0.0011	0.0104	0.5
Loa Loa (eye worm)	cyclin domain-containing protein	0.0131	0.1959	0.1959
Loa Loa (eye worm)	lethal(1)discs large-1 tumor suppressor	0.0005	0.001	0.001
Toxoplasma gondii	histone arginine methyltransferase PRMT1	0.0074	0.1065	0.7041
Trichomonas vaginalis	conserved hypothetical protein	0.0126	0.1877	0.2982
Entamoeba histolytica	arginine N-methyltransferase protein, putative	0.0111	0.1641	0.5005
Brugia malayi	Subtilase family protein	0.0028	0.0359	0.0336
Brugia malayi	Protein kinase domain containing protein	0.0025	0.0309	0.0286
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0359	0.0429
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0783	0.0769
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0025	0.0309	0.0309
Toxoplasma gondii	hypothetical protein	0.01	0.1469	1
Loa Loa (eye worm)	cyclin domain-containing protein	0.0032	0.0419	0.0419
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0028	0.0359	0.0429
Echinococcus granulosus	cyclins	0.0032	0.0419	0.0404
Trypanosoma brucei	subtilisin peptidase	0.0028	0.0359	0.083
Brugia malayi	hypothetical protein	0.003	0.0399	0.0377
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0419	0.0529
Echinococcus multilocularis	cyclin dependent kinase 5	0.0025	0.0309	0.0366
Trichomonas vaginalis	cyclin D, putative	0.0131	0.1959	0.312
Echinococcus multilocularis	cyclin y	0.0032	0.0419	0.0502
Brugia malayi	Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit	0.0049	0.0689	0.0667
Echinococcus granulosus	Furin 1	0.0154	0.2307	0.2296
Brugia malayi	Protein arginine N-methyltransferase	0.004	0.0546	0.0523
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0154	0.2307	0.3706
Onchocerca volvulus		0.0028	0.0359	0.083

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.7079 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	4.4668 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	16.5113 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	18.526 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	23.1093 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))]	ChEMBL.	No reference
Potency (functional)	79.4328 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1514970

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1379232