TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 679.628 | Formula: C34H44Cl2N2O8
H donors: 4 H acceptors: 6 LogP: 3.9 Rotable bonds: 12
Rule of 5 violations (Lipinski): 2
SMILES: ClCCN(c1ccc(cc1)C[C@@H](C(=O)O[C@@H]1[C@H]2CC[C@@H]3[C@@]1(C(=O)C2=C)[C@@]1(O)OC[C@@]23[C@@H](O)CCC([C@H]2[C@@H]1O)(C)C)NC=O)CCCl
InChi: 1S/C34H44Cl2N2O8/c1-19-22-8-9-24-32-17-45-34(44,28(42)26(32)31(2,3)11-10-25(32)40)33(24,27(19)41)29(22)46-30(43)23(37-18-39)16-20-4-6-21(7-5-20)38(14-12-35)15-13-36/h4-7,18,22-26,28-29,40,42,44H,1,8-17H2,2-3H3,(H,37,39)/t22-,23-,24-,25-,26+,28-,29+,32+,33-,34-/m0/s1
InChiKey: CDNVUHQFLVNSSG-PLYXUMBISA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0155	0.0172	0.0172
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0404	0.067	0.067
Trichomonas vaginalis	CMGC family protein kinase	0.0077	0.0016	0.003
Mycobacterium tuberculosis	Serine/threonine-protein kinase transcriptional regulatory protein PknK (protein kinase K) (STPK K)	0.0069	0	0.5
Plasmodium vivax	protein kinase Crk2	0.0958	0.1778	0.331
Echinococcus granulosus	hypothetical protein	0.2684	0.5231	0.5231
Echinococcus granulosus	Cell division cycle 2 protein kinase	0.0077	0.0016	0.0016
Brugia malayi	Protein kinase domain containing protein	0.0077	0.0016	0.0021
Entamoeba histolytica	cell division protein kinase 2, putative	0.0958	0.1778	0.3846
Brugia malayi	Protein kinase domain containing protein	0.2754	0.537	0.7017
Trichomonas vaginalis	CMGC family protein kinase	0.0958	0.1778	0.331
Echinococcus granulosus	cyclin dependent kinase 9	0.0123	0.0107	0.0107
Trichomonas vaginalis	CMGC family protein kinase	0.0958	0.1778	0.331
Trichomonas vaginalis	cyclin B, putative	0.008	0.0021	0.0039
Echinococcus multilocularis	oligomeric golgi complex subunit 3	0.0081	0.0022	0.0022
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0145	0.0151	0.0197
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Echinococcus granulosus	cyclin dependent kinase 7	0.0147	0.0155	0.0155
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.3895	0.7653	1
Echinococcus granulosus	muscleblind protein	0.0155	0.0172	0.0172
Loa Loa (eye worm)	CMGC/CLK protein kinase	0.2754	0.537	0.537
Loa Loa (eye worm)	hypothetical protein	0.008	0.0021	0.0021
Brugia malayi	Cyclin, N-terminal domain containing protein	0.008	0.0021	0.0028
Mycobacterium tuberculosis	Serine/threonine-protein kinase PknG (protein kinase G) (STPK G)	0.0069	0	0.5
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0958	0.1778	0.1778
Schistosoma mansoni	cyclin-dependent kinase 5 activator	0.5068	1	1
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma cruzi	cyclin, putative	0.008	0.0021	0.0039
Trypanosoma cruzi	kinetoplastid kinetochore protein 19, putative	0.2754	0.537	1
Entamoeba histolytica	protein kinase, putative	0.238	0.4622	1
Trypanosoma brucei	cdc2-related kinase 3	0.0958	0.1778	0.331
Brugia malayi	intracellular kinase	0.0404	0.067	0.0876
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	G protein-coupled receptor kinase, putative	0.0077	0.0016	0.003
Echinococcus multilocularis	dual specificity	0.238	0.4622	0.4622
Echinococcus multilocularis	geminin	0.0176	0.0214	0.0214
Loa Loa (eye worm)	hypothetical protein	0.2426	0.4715	0.4715
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0121	0.0102	0.0191
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Schistosoma mansoni	serine/threonine protein kinase	0.1387	0.2636	0.2636
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0121	0.0102	0.0191
Echinococcus multilocularis	serine:threonine protein kinase NLK	0.0077	0.0016	0.0016
Mycobacterium tuberculosis	Probable transmembrane serine/threonine-protein kinase E PknE (protein kinase E) (STPK E)	0.0069	0	0.5
Giardia lamblia	Kinase, CAMK CAMKL	0.0077	0.0016	0.003
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Brugia malayi	cyclin-dependent kinase 7 homolog	0.0155	0.0171	0.0224
Trichomonas vaginalis	CMGC family protein kinase	0.0121	0.0102	0.0191
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0404	0.067	0.067
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0404	0.067	0.1248
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Mycobacterium ulcerans	Ser/Thr protein kinase	0.0069	0	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0958	0.1778	0.1778
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Giardia lamblia	Kinase, CMGC GSK	0.0404	0.067	0.1248
Trichomonas vaginalis	CMGC family protein kinase	0.0404	0.067	0.1248
Brugia malayi	MAP kinase sur-1	0.0121	0.0102	0.0134
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Schistosoma mansoni	serine/threonine protein kinase	0.0115	0.0091	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0155	0.0172	0.0172
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0077	0.0016	0.0016
Trypanosoma cruzi	cdc2-related kinase 1	0.0958	0.1778	0.331
Echinococcus granulosus	protein kinase shaggy	0.0404	0.067	0.067
Loa Loa (eye worm)	cyclin domain-containing protein	0.0145	0.0151	0.0151
Loa Loa (eye worm)	hypothetical protein	0.231	0.4483	0.4483
Leishmania major	serine/threonine kinase-like protein, putative	0.0077	0.0016	0.003
Onchocerca volvulus		0.008	0.0021	0.0028
Trichomonas vaginalis	cyclin B, putative	0.008	0.0021	0.0039
Echinococcus multilocularis	dual specificity protein kinase clk2	0.2754	0.537	0.537
Mycobacterium ulcerans	Ser/Thr protein kinase	0.0069	0	0.5
Trypanosoma cruzi	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.1387	0.2636	0.4908
Entamoeba histolytica	protein kinase domain containing protein	0.0404	0.067	0.145
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0116	0.0116
Trypanosoma cruzi	CYC2-like cyclin, putative	0.008	0.0021	0.0039
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.3895	0.7653	0.7653
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	hypothetical protein	0.2426	0.4715	0.4715
Schistosoma mansoni	serine/threonine protein kinase	0.0147	0.0155	0.0155
Entamoeba histolytica	protein kinase, putative	0.0069	0.00000001247	0.000000026983
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0958	0.1778	0.331
Schistosoma mansoni	serine/threonine protein kinase	0.0121	0.0102	0.0102
Schistosoma mansoni	serine/threonine protein kinase	0.0077	0.0016	0.0016
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Plasmodium falciparum	MO15-related protein kinase	0.0077	0.0016	0.003
Mycobacterium ulcerans	anchored-membrane serine/threonine-protein kinase PknF	0.0069	0	0.5
Mycobacterium ulcerans	serine/threonine-protein kinase transcriptional regulatory protein PknK_3	0.0069	0	0.5
Giardia lamblia	Kinase, CMGC GSK	0.0404	0.067	0.1248
Trypanosoma cruzi	cdc2-related kinase 1	0.0958	0.1778	0.331
Loa Loa (eye worm)	hypothetical protein	0.5068	1	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.0021	0.0021
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Giardia lamblia	Kinase, CAMK CAMKL	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus granulosus	cyclin dependent kinase 1	0.0958	0.1778	0.1778
Trichomonas vaginalis	CMGC family protein kinase	0.0121	0.0102	0.0191
Schistosoma mansoni	protein kinase	0.0077	0.0016	0.0016
Loa Loa (eye worm)	CMGC/CDK/CDK9 protein kinase	0.0115	0.0091	0.0091
Trichomonas vaginalis	cyclins, putative	0.008	0.0021	0.0039
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus granulosus	serine:threonine protein kinase NLK	0.0077	0.0016	0.0016
Echinococcus multilocularis	Cell division cycle 2 protein kinase	0.0077	0.0016	0.0016
Plasmodium falciparum	glycogen synthase kinase 3	0.0404	0.067	0.1248
Loa Loa (eye worm)	CMGC/CDK/CRK7 protein kinase	0.0077	0.0016	0.0016
Echinococcus granulosus	mitogen activated protein kinase	0.0121	0.0102	0.0102
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Giardia lamblia	G2/mitotic-specific cyclin B	0.008	0.0021	0.0039
Trichomonas vaginalis	cyclin B, putative	0.008	0.0021	0.0039
Trypanosoma cruzi	cyclin 6, putative	0.008	0.0021	0.0039
Echinococcus multilocularis		0.2684	0.5231	0.5231
Chlamydia trachomatis	serine/threonine-protein kinase	0.0069	0	0.5
Plasmodium vivax	serine/threonine protein kinase KIN, putative	0.0077	0.0016	0.003
Trypanosoma cruzi	kinetoplastid kinetochore protein 10, putative	0.2754	0.537	1
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	muscleblind protein	0.0155	0.0172	0.0172
Trichomonas vaginalis	CMGC family protein kinase	0.0121	0.0102	0.0191
Mycobacterium ulcerans	transmembrane serine/threonine-protein kinase PknQ	0.0069	0	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0147	0.0155	0.0155
Entamoeba histolytica	protein kinase domain containing protein	0.0404	0.067	0.145
Giardia lamblia	Kinase, CMGC CDK	0.0958	0.1778	0.331
Entamoeba histolytica	cell division protein kinase 2, putative	0.0966	0.1794	0.3881
Loa Loa (eye worm)	haspin protein kinase	0.0077	0.0016	0.0016
Schistosoma mansoni	kinase	0.0115	0.0091	0.0091
Mycobacterium ulcerans	serine/threonine-protein kinase PknG	0.0069	0	0.5
Leishmania major	cyclin	0.008	0.0021	0.0039
Loa Loa (eye worm)	cyclin C	0.0081	0.0022	0.0022
Mycobacterium ulcerans	serine/threonine-protein kinase a PknA	0.0069	0	0.5
Brugia malayi	cell division control protein 2 homolog	0.0958	0.1778	0.2323
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.3895	0.7653	0.7653
Trypanosoma cruzi	cdc2-related kinase 3	0.0958	0.1778	0.331
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	CMGC/DYRK/DYRK1 protein kinase	0.238	0.4622	0.4622
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Leishmania major	serine/threonine-protein kinase, putative,protein kinase, putative	0.238	0.4622	0.8606
Giardia lamblia	Kinase, CMGC CDK	0.0958	0.1778	0.331
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma cruzi	Mitogen-activated protein kinase 10, putative	0.0077	0.0016	0.003
Giardia lamblia	Kinase, CMGC CLK	0.2754	0.537	1
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Toxoplasma gondii	cell-cycle-associated protein kinase CLK, putative	0.2754	0.537	1
Brugia malayi	Muscleblind-like protein	0.0155	0.0172	0.0225
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma brucei	kinetoplastid kinetochore protein 10	0.2754	0.537	1
Echinococcus granulosus	dual specificity	0.1387	0.2636	0.2636
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0016	0.003
Echinococcus granulosus	cyclin B	0.008	0.0021	0.0021
Brugia malayi	Protein kinase domain containing protein	0.3895	0.7653	1
Trichomonas vaginalis	cyclin A, putative	0.008	0.0021	0.0039
Schistosoma mansoni	serine/threonine protein kinase	0.3895	0.7653	0.7653
Trypanosoma cruzi	cyclin, putative	0.008	0.0021	0.0039
Giardia lamblia	Kinase, CAMK CAMKL	0.0077	0.0016	0.003
Plasmodium falciparum	protein serine/threonine kinase-1	0.2754	0.537	1
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma brucei	Mitogen-activated protein kinase 10, putative	0.0077	0.0016	0.003
Echinococcus granulosus	dual specificity	0.1387	0.2636	0.2636
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0121	0.0102	0.0191
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	dual specificity	0.1387	0.2636	0.2636
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.3895	0.7653	1
Trichomonas vaginalis	protein kinase atmrk1, putative	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Brugia malayi	hypothetical protein	0.2426	0.4715	0.6161
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Trypanosoma brucei	dual specificity tyrosine-phosphorylation-regulated kinase 2, putative	0.1387	0.2636	0.4908
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0958	0.1778	0.1778
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Schistosoma mansoni	serine/threonine kinase	0.0077	0.0016	0.0016
Trichomonas vaginalis	serine/threonine kinase, putative	0.0077	0.0016	0.003
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma brucei	cdc2-related kinase 1	0.0958	0.1778	0.331
Trypanosoma brucei	protein kinase, putative	0.0128	0.0118	0.022
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.3895	0.7653	0.7653
Echinococcus granulosus	mitogen activated protein kinase 3	0.0121	0.0102	0.0102
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Mycobacterium leprae	Probable transmembrane serine/threonine-protein kinase B PknB (protein kinase B) (STPK B)	0.0069	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0077	0.0016	0.0035
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0312	0.0486	0.0486
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma brucei	ULK family serine/threonine-protein kinase, putative	0.0075	0.0011	0.0021
Echinococcus multilocularis	cyclin dependent kinase 5	0.0958	0.1778	0.1778
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0404	0.067	0.1248
Schistosoma mansoni	cyclin B	0.008	0.0021	0.0021
Echinococcus granulosus	cyclin dependent kinase 9	0.0115	0.0091	0.0091
Trypanosoma cruzi	serine/threonine protein kinase, putative	0.0077	0.0016	0.003
Leishmania major	protein kinase, putative,dual-specificity protein kinase, putative	0.1387	0.2636	0.4908
Leishmania major	mitogen-activated protein kinase, putative,map kinase-like protein	0.0077	0.0016	0.003
Trichomonas vaginalis	CMGC family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	cyclin dependent kinase 5 activator 1	0.5068	1	1
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trichomonas vaginalis	CMGC family protein kinase	0.0121	0.0102	0.0191
Schistosoma mansoni	serine/threonine protein kinase	0.238	0.4622	0.4622
Mycobacterium tuberculosis	Transmembrane serine/threonine-protein kinase A PknA (protein kinase A) (STPK A)	0.0069	0	0.5
Echinococcus granulosus	cyclin	0.0081	0.0022	0.0022
Trichomonas vaginalis	CMGC family protein kinase	0.0077	0.0016	0.003
Plasmodium vivax	serine/threonine kinase-1, putative	0.2754	0.537	1
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.238	0.4622	0.8606
Loa Loa (eye worm)	hypothetical protein	0.0889	0.1639	0.1639
Brugia malayi	cyclin-dependent kinase 9	0.0115	0.0091	0.0119
Leishmania major	protein kinase, putative	0.2754	0.537	1
Schistosoma mansoni	serine/threonine protein kinase	0.0958	0.1778	0.1778
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0121	0.0102	0.0191
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Mycobacterium tuberculosis	Transmembrane serine/threonine-protein kinase B PknB (protein kinase B) (STPK B)	0.0069	0	0.5
Echinococcus granulosus	snurportin 1	0.0312	0.0486	0.0486
Mycobacterium ulcerans	serine/threonine-protein kinase B PknB	0.0069	0	0.5
Loa Loa (eye worm)	CMGC/DYRK/DYRK2 protein kinase	0.1387	0.2636	0.2636
Trichomonas vaginalis	CMGC family protein kinase	0.2754	0.537	1
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0121	0.0102	0.0102
Trichomonas vaginalis	CMGC family protein kinase	0.0404	0.067	0.1248
Echinococcus multilocularis	cyclin	0.0081	0.0022	0.0022
Trichomonas vaginalis	CMGC family protein kinase	0.1387	0.2636	0.4908
Entamoeba histolytica	cyclin, putative	0.008	0.0021	0.0046
Schistosoma mansoni	hypothetical protein	0.0176	0.0214	0.0214
Echinococcus multilocularis	cyclin dependent kinase 9	0.0115	0.0091	0.0091
Entamoeba histolytica	protein kinase, putative	0.0404	0.067	0.145
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.238	0.4622	0.8606
Plasmodium falciparum	protein kinase 5	0.0958	0.1778	0.331
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Entamoeba histolytica	protein kinase domain containing protein	0.1387	0.2636	0.5703
Brugia malayi	Cell division protein kinase 2	0.0077	0.0016	0.0021
Onchocerca volvulus		0.0404	0.067	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	mitogen activated protein kinase	0.0121	0.0102	0.0102
Echinococcus multilocularis	protein kinase shaggy	0.0404	0.067	0.067
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	dual specificity	0.1387	0.2636	0.2636
Trichomonas vaginalis	CMGC family protein kinase	0.0958	0.1778	0.331
Trypanosoma brucei	kinetoplastid kinetochore protein 19	0.2754	0.537	1
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0116	0.0116
Trypanosoma brucei	CMGC/DYRK protein kinase, putative	0.238	0.4622	0.8606
Trichomonas vaginalis	CMGC family protein kinase	0.0077	0.0016	0.003
Loa Loa (eye worm)	CMGC/CDK/CDK7 protein kinase	0.0147	0.0155	0.0155
Echinococcus granulosus	mitogen activated protein kinase 15	0.0077	0.0016	0.0016
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0404	0.067	0.067
Mycobacterium tuberculosis	Anchored-membrane serine/threonine-protein kinase PknF (protein kinase F) (STPK F)	0.0069	0	0.5
Echinococcus multilocularis	cyclin dependent kinase 1	0.0958	0.1778	0.1778
Echinococcus multilocularis	dual specificity	0.1387	0.2636	0.2636
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0958	0.1778	0.331
Echinococcus granulosus	cyclin dependent kinase 5	0.0958	0.1778	0.1778
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0121	0.0102	0.0191
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0404	0.067	0.067
Echinococcus granulosus	oligomeric golgi complex subunit 3	0.0081	0.0022	0.0022
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0121	0.0102	0.0191
Plasmodium vivax	cyclin dependent kinase 7 (cdk7), putative	0.0077	0.0016	0.003
Schistosoma mansoni	serine/threonine protein kinase	0.2754	0.537	0.537
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.3895	0.7653	0.7653
Mycobacterium leprae	Probable transmembrane serine/threonine-protein kinase A PknA (protein kinase A) (STPK A)	0.0069	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Onchocerca volvulus	Huntingtin homolog	0.0128	0.0116	0.0152
Mycobacterium ulcerans	Ser/Thr protein kinase	0.0069	0	0.5
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0404	0.067	0.1248
Mycobacterium tuberculosis	Probable transmembrane serine/threonine-protein kinase I PknI (protein kinase I) (STPK I) (phosphorylase B kinase kinase) (hydro	0.0069	0	0.5
Echinococcus granulosus	dual specificity	0.1387	0.2636	0.2636
Brugia malayi	Protein kinase domain containing protein	0.238	0.4622	0.6039
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0958	0.1778	0.1778
Loa Loa (eye worm)	hypothetical protein	0.2684	0.5231	0.5231
Chlamydia trachomatis	serine/threonine protein kinase	0.0069	0	0.5
Echinococcus granulosus	dual specificity	0.238	0.4622	0.4622
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Echinococcus multilocularis	snurportin 1	0.0312	0.0486	0.0486
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0121	0.0102	0.0102
Brugia malayi	Cyclin, N-terminal domain containing protein	0.008	0.0021	0.0028
Mycobacterium ulcerans	Ser/Thr protein kinase	0.0069	0	0.5
Trypanosoma brucei	mitotic cyclin 6	0.008	0.0021	0.0039
Trichomonas vaginalis	cyclins, putative	0.008	0.0021	0.0039
Echinococcus granulosus	dual specificity protein kinase clk2	0.2754	0.537	0.537
Schistosoma mansoni	hypothetical protein	0.0176	0.0214	0.0214
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.008	0.0021	0.0039
Brugia malayi	Cyclin C	0.0081	0.0022	0.0029
Echinococcus multilocularis	cyclin dependent kinase	0.0958	0.1778	0.1778
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0121	0.0102	0.0191
Trypanosoma brucei	protein kinase, putative	0.0404	0.067	0.1248
Entamoeba histolytica	hypothetical protein	0.238	0.4622	1
Leishmania major	protein kinase, putative	0.2754	0.537	1
Brugia malayi	Protein kinase domain containing protein	0.0958	0.1778	0.2323
Schistosoma mansoni	serine/threonine protein kinase	0.2754	0.537	0.537
Mycobacterium tuberculosis	Probable transmembrane serine/threonine-protein kinase H PknH (protein kinase H) (STPK H)	0.0069	0	0.5
Trichomonas vaginalis	cyclins, putative	0.008	0.0021	0.0039
Trichomonas vaginalis	cyclins, putative	0.008	0.0021	0.0039
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0958	0.1778	0.1778
Entamoeba histolytica	protein kinase, putative	0.1387	0.2636	0.5703
Echinococcus multilocularis	cyclin dependent kinase 7	0.0147	0.0155	0.0155
Entamoeba histolytica	protein kinase domain containing protein	0.238	0.4622	1
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Entamoeba histolytica	protein kinase domain containing protein	0.0115	0.0091	0.0197
Entamoeba histolytica	protein kinase, putative	0.238	0.4622	1
Echinococcus multilocularis	muscleblind protein 1	0.0155	0.0172	0.0172
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0121	0.0102	0.0191
Brugia malayi	Dual-specificity tyrosine-phosphorylation regulated kinase 2	0.1387	0.2636	0.3444
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Schistosoma mansoni	g1/s-specific cyclin C	0.0081	0.0022	0.0022
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0958	0.1778	0.331
Echinococcus granulosus	geminin	0.0176	0.0214	0.0214
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma cruzi	kinetoplastid kinetochore protein 10, putative	0.2754	0.537	1
Trypanosoma cruzi	kinetoplastid kinetochore protein 19, putative	0.2754	0.537	1
Trypanosoma cruzi	Mitogen-activated protein kinase 10, putative	0.0077	0.0016	0.003
Giardia lamblia	Kinase, CMGC MAPK	0.0121	0.0102	0.0191
Mycobacterium ulcerans	membrane-anchored serine/threonine-protein kinase	0.0069	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.231	0.4483	0.4483
Echinococcus multilocularis	cyclin dependent kinase 1	0.0958	0.1778	0.1778
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Mycobacterium leprae	PROBABLE TRANSMEMBRANE SERINE/THREONINE-PROTEIN KINASE L PKNL (PROTEIN KINASE L) (STPK L)	0.0069	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Mycobacterium ulcerans	serine/threonine-protein kinase transcriptional regulatory protein PknK_2	0.0069	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Trypanosoma cruzi	cdc2-related kinase 3	0.0958	0.1778	0.331
Chlamydia trachomatis	serine/threonine protein kinase	0.0069	0	0.5
Onchocerca volvulus	Huntingtin homolog	0.0128	0.0116	0.0152
Trichomonas vaginalis	CAMK family protein kinase	0.0077	0.0016	0.003
Schistosoma mansoni	hypothetical protein	0.0312	0.0486	0.0486
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0404	0.067	0.1248
Brugia malayi	RNA, U transporter 1	0.0083	0.0028	0.0036
Echinococcus multilocularis	cyclin dependent kinase 9	0.0123	0.0107	0.0107
Toxoplasma gondii	cell-cycle-associated protein kinase DYRK2, putative	0.1387	0.2636	0.4908
Mycobacterium ulcerans	serine/threonine-protein kinase PknF_2	0.0069	0	0.5
Brugia malayi	hypothetical protein	0.0128	0.0116	0.0152
Trichomonas vaginalis	cyclin B, putative	0.008	0.0021	0.0039
Echinococcus granulosus	cyclin dependent kinase	0.0958	0.1778	0.1778
Echinococcus multilocularis	cyclin B	0.008	0.0021	0.0021
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0404	0.067	0.067
Giardia lamblia	Kinase, CMGC DYRK	0.1387	0.2636	0.4908

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 14.58 uM	Antiproliferative activity against human MCF7 cells assessed as growth inhibition after 72 hrs by MTT assay	ChEMBL.	25050168

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	25050168

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.

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External resources for this compound

ChEMBL: CHEMBL3323219

Bibliographic References

No literature references available for this target.

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Detailed information for compound 924387