TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 376.254 | Formula: C15H18BrN7
H donors: 2 H acceptors: 3 LogP: 0.75 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Cn1ncc(c1)c1cnn2c1nc(C1CCNCC1)c(c2N)Br
InChi: 1S/C15H18BrN7/c1-22-8-10(6-19-22)11-7-20-23-14(17)12(16)13(21-15(11)23)9-2-4-18-5-3-9/h6-9,18H,2-5,17H2,1H3
InChiKey: NEALKBLXTUUQMA-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	cyclin-dependent kinase 3		References
Homo sapiens	checkpoint kinase 1	Starlite/ChEMBL	References
Homo sapiens	cyclin A2		References
Homo sapiens	cyclin A1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Entamoeba histolytica	cell division protein kinase 2, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_130454	All targets in OG5_130454
Echinococcus granulosus	cyclin dependent kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma congolense	mitotic cyclin 6	Get druggable targets OG5_126649	All targets in OG5_126649
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Babesia bovis	cell division control protein 2, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma brucei	cdc2-related kinase 3	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cdc2-related kinase 3	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania braziliensis	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_130454	All targets in OG5_130454
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Cryptosporidium hominis	mitotic cyclin-CYC2	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely G2 B-type cyclin similar to S. cerevisiae CLB1 (YPR119W) which is involved in mitotic induction	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Giardia lamblia	Kinase, CMGC CDK	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania donovani	cdc2-related kinase 3, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Plasmodium yoelii	cdc2-related kinase 2	Get druggable targets OG5_126712	All targets in OG5_126712
Schistosoma japonicum	Serine/threonine-protein kinase Chk1, putative	Get druggable targets OG5_130454	All targets in OG5_130454
Plasmodium knowlesi	Cell division control protein 2 homolog	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cdc2-related kinase 3	Get druggable targets OG5_126712	All targets in OG5_126712
Brugia malayi	Cyclin, N-terminal domain containing protein	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Giardia lamblia	Kinase, CMGC CDK	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania infantum	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Cryptosporidium parvum	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania major	cell division protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely B-type cyclin similar to S. cerevisiae CLB4 (YLR210W) and CLB3 (YDL155W) involved in G1/S transition	Get druggable targets OG5_126649	All targets in OG5_126649
Brugia malayi	cell division control protein 2 homolog	Get druggable targets OG5_126712	All targets in OG5_126712
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_126712	All targets in OG5_126712
Plasmodium vivax	protein kinase Crk2	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	cyclin A, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus multilocularis	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cdc2-related kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Plasmodium falciparum	protein kinase 5	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus multilocularis	cyclin dependent kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania braziliensis	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania infantum	cell division protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Echinococcus multilocularis	cyclin dependent kinase 5	Get druggable targets OG5_126712	All targets in OG5_126712
Cryptosporidium hominis	cdc2-like protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania donovani	CYC2-like cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	CYC2-like cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Cryptosporidium parvum	Cdc2-like CDK2/CDC28 like protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus granulosus	cyclin dependent kinase 5	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania donovani	cell division protein kinase 2	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma brucei gambiense	cyclin 6,mitotic cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma japonicum	ko:K02087 cyclin-dependent kinase 1, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma brucei	cdc2-related kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania donovani	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Echinococcus granulosus	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Schistosoma japonicum	ko:K02090 cyclin-dependent kinase 5, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cdc2-related kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania infantum	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania infantum	cell division related protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Candida albicans	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma cruzi	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Theileria parva	cell division control protein 2 related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma congolense	Cyclin, N-terminal domain/Cyclin, C-terminal domain containing protein, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Onchocerca volvulus		Get druggable targets OG5_126649	All targets in OG5_126649
Echinococcus multilocularis	cyclin dependent kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus granulosus	cyclin dependent kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Neospora caninum	CMGC kinase, CDK family TgPK2, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma brucei	mitotic cyclin 6	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma congolense	cdc2-related kinase 3, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Echinococcus multilocularis	cyclin dependent kinase 1	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania mexicana	cell division related protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Candida albicans	likely G2 B-type cyclin similar to S. cerevisiae CLB1 (YPR119W) which is involved in mitotic induction	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma brucei gambiense	cell division protein kinase 2 homolog 1,cdc2- like protein kinase, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Giardia lamblia	G2/mitotic-specific cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Entamoeba histolytica	cell division protein kinase 2, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Candida albicans	Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Plasmodium berghei	cdc2-related kinase 2	Get druggable targets OG5_126712	All targets in OG5_126712
Brugia malayi	Cyclin, N-terminal domain containing protein	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Trypanosoma congolense	cdc2-related kinase 1, putative	Get druggable targets OG5_126712	All targets in OG5_126712
Entamoeba histolytica	cyclin, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania mexicana	CYC2-like cyclin, putative,cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania mexicana	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania mexicana	cell division protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania braziliensis	cell division related protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Schistosoma mansoni	cyclin B	Get druggable targets OG5_126649	All targets in OG5_126649
Trichomonas vaginalis	cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	cyclins, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	CAMK/CAMKL/CHK1 protein kinase	Get druggable targets OG5_130454	All targets in OG5_130454
Candida albicans	Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Leishmania braziliensis	cell division protein kinase 2,cdc2-related kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma brucei gambiense	cell division related protein kinase 2, putative,CDC2-related protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Trypanosoma cruzi	cyclin 6, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	Get druggable targets OG5_126712	All targets in OG5_126712
Schistosoma japonicum	ko:K05868 cyclin B, putative	Get druggable targets OG5_126649	All targets in OG5_126649
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126649	All targets in OG5_126649
Leishmania major	cyclin	Get druggable targets OG5_126649	All targets in OG5_126649

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	cyclin-dependent kinase 3	305 aa	303 aa	32.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	cyclins, putative	0.009	0.2061	0.7669
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Trypanosoma cruzi	cysteine peptidase, putative	0.0057	0.086	0.086
Trypanosoma brucei	cdc2-related kinase 3	0.0053	0.0691	0.2573
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0057	0.086	0.0735
Echinococcus granulosus	cyclin dependent kinase 1	0.0053	0.0691	0.0691
Entamoeba histolytica	cell division protein kinase 2, putative	0.0053	0.0691	0.3355
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Giardia lamblia	Cathepsin B precursor	0.0107	0.2688	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Brugia malayi	cathepsin L-like precursor	0.0041	0.0274	0.0274
Plasmodium falciparum	cyclin	0.0038	0.0135	0.1572
Entamoeba histolytica	cysteine proteinase, putative	0.0057	0.086	0.4174
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0053	0.0691	0.0691
Echinococcus granulosus	cathepsin b	0.0306	1	1
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Trypanosoma cruzi	cdc2-related kinase 3	0.0053	0.0691	0.0691
Trypanosoma cruzi	cdc2-related kinase 3	0.0053	0.0691	0.0691
Onchocerca volvulus		0.0057	0.086	0.3282
Schistosoma mansoni	cathepsin F (C01 family)	0.0057	0.086	0.086
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0306	1	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0057	0.086	0.086
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.0135	0.0503
Loa Loa (eye worm)	cysteine protease	0.0057	0.086	0.0735
Toxoplasma gondii	cathepsin B	0.0107	0.2688	1
Trichomonas vaginalis	cyclin D, putative	0.0038	0.0135	0.0503
Entamoeba histolytica	cysteine proteinase, putative	0.0041	0.0274	0.1328
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0306	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0306	1	1
Loa Loa (eye worm)	ctsf protein	0.0057	0.086	0.0735
Entamoeba histolytica	cysteine protease, putative	0.0057	0.086	0.4174
Brugia malayi	Papain family cysteine protease containing protein	0.0057	0.086	0.086
Trypanosoma cruzi	cyclin, putative	0.009	0.2061	0.2061
Onchocerca volvulus		0.009	0.2061	1
Brugia malayi	Protein kinase domain containing protein	0.0203	0.6196	0.6196
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0691	0.2573
Schistosoma mansoni	cyclin B3	0.0038	0.0135	0.0135
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Trypanosoma cruzi	cysteine peptidase, putative	0.0057	0.086	0.086
Loa Loa (eye worm)	hypothetical protein	0.009	0.2061	0.1952
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.009	0.2061	0.6861
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.0691	0.0691
Trichomonas vaginalis	cyclin A, putative	0.009	0.2061	0.7669
Giardia lamblia	Cathepsin B precursor	0.0107	0.2688	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0057	0.086	0.086
Echinococcus granulosus	cyclin B	0.009	0.2061	0.2061
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0041	0.0274	0.0274
Brugia malayi	cell division control protein 2 homolog	0.0053	0.0691	0.0691
Echinococcus multilocularis	cyclin dependent kinase 1	0.0053	0.0691	0.0691
Loa Loa (eye worm)	fibroinase	0.0057	0.086	0.0735
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Onchocerca volvulus	Cathepsin L homolog	0.0057	0.086	0.3282
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0691	0.2573
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Onchocerca volvulus		0.0057	0.086	0.3282
Echinococcus multilocularis	cysteine protease	0.0057	0.086	0.086
Plasmodium vivax	vivapain-2	0.0057	0.086	1
Giardia lamblia	Kinase, CMGC CDK	0.0053	0.0691	0.2179
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0038	0.0135	0.0135
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0107	0.2688	0.2688
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Echinococcus multilocularis	cysteine protease	0.0057	0.086	0.086
Brugia malayi	Cathepsin L-like precursor	0.0041	0.0274	0.0274
Trichomonas vaginalis	cyclin B, putative	0.009	0.2061	0.7669
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0274	0.014
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0041	0.0274	0.1018
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0057	0.086	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Echinococcus multilocularis	cathepsin L cysteine protease	0.0057	0.086	0.086
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Echinococcus granulosus	cyclins	0.0038	0.0135	0.0135
Onchocerca volvulus	Cathepsin F homolog	0.0057	0.086	0.3282
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.0691	0.0691
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0053	0.0691	0.0564
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0057	0.086	0.086
Toxoplasma gondii	cathepsin CPL	0.0057	0.086	0.0846
Trypanosoma cruzi	CYC2-like cyclin, putative	0.009	0.2061	0.2061
Echinococcus multilocularis	cyclin b3	0.0038	0.0135	0.0135
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0691	0.2573
Trypanosoma cruzi	cysteine peptidase, putative	0.0057	0.086	0.086
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0306	1	1
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0053	0.0691	0.0564
Brugia malayi	Cyclin, N-terminal domain containing protein	0.009	0.2061	0.2061
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0053	0.0691	0.0564
Leishmania major	cyclin	0.009	0.2061	0.6861
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0057	0.086	0.3201
Brugia malayi	Cyclin, N-terminal domain containing protein	0.009	0.2061	0.2061
Trypanosoma cruzi	cdc2-related kinase 1	0.0053	0.0691	0.0691
Entamoeba histolytica	cysteine proteinase, putative	0.0057	0.086	0.4174
Trypanosoma cruzi	cysteine peptidase, putative	0.0057	0.086	0.086
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0274	0.014
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0651	0.0522
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0057	0.086	0.0735
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Leishmania major	cysteine peptidase A (CPA)	0.0057	0.086	0.0846
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Echinococcus granulosus	cyclins	0.0038	0.0135	0.0135
Echinococcus multilocularis	cathepsin b	0.0306	1	1
Trichomonas vaginalis	cyclin B, putative	0.0038	0.0135	0.0503
Onchocerca volvulus		0.0057	0.086	0.3282
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Echinococcus granulosus	cyclin dependent kinase 5	0.0053	0.0691	0.0691
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0684	0.0557
Loa Loa (eye worm)	hypothetical protein	0.0306	1	1
Trichomonas vaginalis	cyclins, putative	0.009	0.2061	0.7669
Trypanosoma brucei	cdc2-related kinase 1	0.0053	0.0691	0.2573
Schistosoma mansoni	cathepsin F (C01 family)	0.0041	0.0274	0.0274
Echinococcus multilocularis	cyclin B3 1	0.0038	0.0135	0.0135
Entamoeba histolytica	cyclin, putative	0.009	0.2061	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Plasmodium vivax	vivapain-2	0.0057	0.086	1
Schistosoma mansoni	cyclin B	0.009	0.2061	0.2061
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0057	0.086	0.3201
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Echinococcus multilocularis	cyclin dependent kinase	0.0053	0.0691	0.0691
Trypanosoma cruzi	cyclin, putative	0.009	0.2061	0.2061
Giardia lamblia	Kinase, CMGC CDK	0.0053	0.0691	0.2179
Echinococcus granulosus	cyclins	0.0038	0.0135	0.0135
Echinococcus granulosus	cathepsin l1	0.0057	0.086	0.086
Loa Loa (eye worm)	cathepsin B	0.0107	0.2688	0.2587
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Trichomonas vaginalis	cyclins, putative	0.0038	0.0135	0.0503
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0038	0.0135	0.0135
Trichomonas vaginalis	cyclin B3, putative	0.0038	0.0135	0.0503
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Trichomonas vaginalis	cyclin B, putative	0.009	0.2061	0.7669
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Entamoeba histolytica	cyclin family protein	0.0038	0.0135	0.0656
Schistosoma mansoni	serine/threonine protein kinase	0.0203	0.6196	0.6196
Trichomonas vaginalis	cyclins, putative	0.009	0.2061	0.7669
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0107	0.2688	1
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Entamoeba histolytica	cell division protein kinase 2, putative	0.0053	0.0691	0.3355
Echinococcus granulosus	cyclin b3	0.0038	0.0135	0.0135
Leishmania major	cathepsin L-like protease	0.0057	0.086	0.0846
Echinococcus multilocularis	cyclin dependent kinase 1	0.0053	0.0691	0.0691
Schistosoma mansoni	cathepsin F (C01 family)	0.0057	0.086	0.086
Echinococcus granulosus	cathepsin l1	0.0041	0.0274	0.0274
Giardia lamblia	G2/mitotic-specific cyclin B	0.009	0.2061	0.7545
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0057	0.086	0.086
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Entamoeba histolytica	cyclin, putative	0.0038	0.0135	0.0656
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Echinococcus multilocularis	cathepsin L cysteine protease	0.0057	0.086	0.086
Echinococcus granulosus	cyclins	0.0038	0.0135	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0274	0.014
Echinococcus multilocularis	cyclins	0.0038	0.0135	0.0135
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Trypanosoma cruzi	cdc2-related kinase 1	0.0053	0.0691	0.0691
Echinococcus granulosus	cathepsin b	0.0306	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Trypanosoma brucei	mitotic cyclin 6	0.009	0.2061	0.7669
Brugia malayi	Cathepsin L-like precursor	0.0041	0.0274	0.0274
Echinococcus multilocularis	cyclin B	0.009	0.2061	0.2061
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Brugia malayi	Protein kinase domain containing protein	0.0053	0.0691	0.0691
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0057	0.086	1
Loa Loa (eye worm)	hypothetical protein	0.009	0.2061	0.1952
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0107	0.2688	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Trichomonas vaginalis	cyclin B, putative	0.009	0.2061	0.7669
Giardia lamblia	Cathepsin B precursor	0.0107	0.2688	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0057	0.086	0.086
Echinococcus granulosus	cyclins	0.0038	0.0135	0.0135
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0057	0.086	1
Onchocerca volvulus	Cathepsin L homolog	0.0057	0.086	0.3282
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0041	0.0274	0.1018
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0107	0.2688	0.2688
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0107	0.2688	1
Trypanosoma cruzi	cyclin 6, putative	0.009	0.2061	0.2061
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Entamoeba histolytica	cyclin family protein	0.0038	0.0135	0.0656
Echinococcus multilocularis	cathepsin b	0.0306	1	1
Schistosoma mansoni	cyclins	0.0038	0.0135	0.0135
Trichomonas vaginalis	cyclins, putative	0.0062	0.1017	0.3783
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0306	1	1
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0038	0.0135	0.0135
Echinococcus granulosus	cyclin dependent kinase	0.0053	0.0691	0.0691
Loa Loa (eye worm)	hypothetical protein	0.0057	0.086	0.0735
Trichomonas vaginalis	cyclin B, putative	0.009	0.2061	0.7669
Onchocerca volvulus		0.0057	0.086	0.3282
Plasmodium falciparum	protein kinase 5	0.0053	0.0691	0.8037
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0041	0.0274	0.0274
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0057	0.086	0.3201
Echinococcus granulosus	cyclin B3 1	0.0038	0.0135	0.0135
Onchocerca volvulus		0.0057	0.086	0.3282
Echinococcus multilocularis	cyclin dependent kinase 5	0.0053	0.0691	0.0691
Plasmodium vivax	protein kinase Crk2	0.0053	0.0691	0.8037
Trichomonas vaginalis	cyclin D, putative	0.0038	0.0135	0.0503
Brugia malayi	Cathepsin L-like precursor	0.0057	0.086	0.086
Onchocerca volvulus		0.0057	0.086	0.3282
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0057	0.086	0.3201
Loa Loa (eye worm)	CAMK/CAMKL/CHK1 protein kinase	0.0203	0.6196	0.6144
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0057	0.086	0.3201
Onchocerca volvulus		0.0057	0.086	0.3282
Trichomonas vaginalis	cyclins, putative	0.009	0.2061	0.7669

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.035 uM	Inhibition of histidine-tagged recombinant CHK1 expressed in baculovirus expression system after 2 hrs by scintillation proximity assay	ChEMBL.	21094607
IC50 (binding)	= 0.49 uM	Inhibition of recombinant CDK2/Cyclin A expressed in insect Sf9 cells assessed as inhibition of [33P]-ATP incorporation into biotinylated histone H1 after 1 hr by liquid scintillation counting	ChEMBL.	21094607

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: CHEMBL1643228

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1461637