TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 621.181 | Formula: C15H19BrN4O14P2
H donors: 6 H acceptors: 10 LogP: -4.75 Rotable bonds: 0
Rule of 5 violations (Lipinski): 3
SMILES: O[C@@H]1[C@H]2COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4c5ncn([C@@H]([C@@H]1O)O2)c(=O)c5nc4Br)[C@@H]([C@@H]3O)O
InChi: 1S/C15H19BrN4O14P2/c16-15-18-6-11-17-3-19(12(6)25)13-9(23)7(21)4(32-13)1-30-35(26,27)34-36(28,29)31-2-5-8(22)10(24)14(33-5)20(11)15/h3-5,7-10,13-14,21-24H,1-2H2,(H,26,27)(H,28,29)/t4-,5-,7-,8-,9-,10-,13-,14-/m1/s1
InChiKey: HKSNKDATBYRUKD-AIKIOGRUSA-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
Echinococcus granulosus	Rac GTPase activating protein 1	0.0187	0.0872	0.0872
Loa Loa (eye worm)	hypothetical protein	0.0339	0.2543	0.2756
Trypanosoma brucei	mitotic cyclin 6	0.0235	0.1397	0.5494
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0236	0.1416	0.5569
Giardia lamblia	Hypothetical protein	0.0182	0.0822	0.3233
Echinococcus granulosus	protein kinase c eta type	0.0187	0.0872	0.0872
Brugia malayi	Hr1 repeat family protein	0.025	0.1566	0.2026
Trichomonas vaginalis	cyclin A, putative	0.0235	0.1397	0.5494
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Schistosoma mansoni	cyclins	0.0182	0.0822	0.0822
Loa Loa (eye worm)	hypothetical protein	0.0129	0.0234	0.0254
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.03	0.211	0.211
Entamoeba histolytica	cyclin family protein	0.0182	0.0822	0.2882
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0367	0.2853	1
Toxoplasma gondii	AGC kinase	0.025	0.1566	0.6159
Entamoeba histolytica	protein kinase, putative	0.025	0.1566	0.5489
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Echinococcus multilocularis	cyclin B3 1	0.0182	0.0822	0.0822
Schistosoma mansoni	serine/threonine kinase	0.025	0.1566	0.1566
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.015	0.0475	0.1868
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Trichomonas vaginalis	cyclin B, putative	0.0235	0.1397	0.5494
Loa Loa (eye worm)	RasGEF domain-containing protein	0.0187	0.0872	0.0945
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0343	0.259	0.9079
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0394	0.3145	0.3145
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0187	0.0872	0.0872
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Onchocerca volvulus		0.0213	0.116	0.1788
Giardia lamblia	NAD-dependent histone deacetylase Sir2	0.015	0.0475	0.1868
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.015	0.0475	0.1868
Brugia malayi	Protein kinase domain containing protein	0.0181	0.0815	0.1053
Schistosoma mansoni	cyclin B3	0.03	0.211	0.211
Echinococcus granulosus	cyclins	0.0182	0.0822	0.0822
Toxoplasma gondii	diacylglycerol kinase, putative	0.0187	0.0872	0.3431
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 2	0.0339	0.2543	1
Trichomonas vaginalis	cyclin B, putative	0.0235	0.1397	0.5494
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.025	0.1566	0.1566
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Schistosoma mansoni	diacylglycerol kinase theta	0.0187	0.0872	0.0872
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0556	0.4923	0.4923
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0235	0.1397	0.1807
Trichomonas vaginalis	cyclin D, putative	0.0182	0.0822	0.3233
Brugia malayi	cAMP-dependent protein kinase catalytic subunit, putative	0.0339	0.2543	0.3289
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.025	0.1566	0.1697
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 3	0.0339	0.2543	1
Echinococcus granulosus	chromatin regulatory protein sir2	0.0135	0.0306	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0699	0.6487	0.7029
Echinococcus granulosus	unc 13 munc13	0.0213	0.116	0.116
Schistosoma mansoni	chromatin regulatory protein sir2	0.0135	0.0306	0.0306
Toxoplasma gondii	protein kinase, cAMP-dependent, catalytic chain	0.0339	0.2543	1
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.025	0.1566	0.1566
Trichomonas vaginalis	cyclins, putative	0.0235	0.1397	0.5494
Leishmania major	protein kinase A catalytic subunit	0.0339	0.2543	1
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.015	0.0475	0.1868
Schistosoma mansoni	hypothetical protein	0.0187	0.0872	0.0872
Loa Loa (eye worm)	hypothetical protein	0.0885	0.8535	0.9248
Onchocerca volvulus		0.0699	0.6487	1
Schistosoma mansoni	serine/threonine protein kinase	0.0339	0.2543	0.2543
Schistosoma mansoni	protein kinase C mu	0.0187	0.0872	0.0872
Entamoeba histolytica	cyclin, putative	0.0235	0.1397	0.4897
Brugia malayi	protein kinase C II.	0.0812	0.7732	1
Echinococcus granulosus	N chimaerin	0.0187	0.0872	0.0872
Trypanosoma cruzi	cyclin, putative	0.0235	0.1397	0.5494
Loa Loa (eye worm)	Ras association domain family 1 isoform A	0.0187	0.0872	0.0945
Echinococcus granulosus	NAD dependent deacetylase sirtuin 3	0.0135	0.0306	0.0306
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Onchocerca volvulus		0.0129	0.0234	0.0361
Entamoeba histolytica	hypothetical protein	0.0187	0.0872	0.3058
Brugia malayi	Protein kinase domain containing protein	0.0254	0.1614	0.2087
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0812	0.7732	0.8379
Echinococcus granulosus	cyclin B	0.0235	0.1397	0.1397
Loa Loa (eye worm)	hypothetical protein	0.0235	0.1397	0.1514
Echinococcus multilocularis	protein kinase c epsilon type	0.0812	0.7732	0.7732
Toxoplasma gondii	AGC kinase	0.0339	0.2543	1
Brugia malayi	NAD-dependent deacetylase SIRT1	0.015	0.0475	0.0614
Leishmania major	silent information regulator 2, putative	0.0135	0.0306	0.1204
Trichomonas vaginalis	cyclins, putative	0.0182	0.0822	0.3233
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Brugia malayi	C1-like domain containing protein	0.0329	0.2432	0.3145
Trypanosoma brucei	cAMP-dependent protein kinase catalytic subunit 2	0.0339	0.2543	1
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Echinococcus granulosus	cyclin B3 1	0.0182	0.0822	0.0822
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 1	0.0339	0.2543	1
Schistosoma mansoni	serine/threonine protein kinase	0.02	0.1022	0.1022
Schistosoma mansoni	serine/threonine protein kinase	0.025	0.1566	0.1566
Echinococcus multilocularis	chromatin regulatory protein sir2	0.0135	0.0306	0.0306
Echinococcus granulosus	enhancer of mRNA decapping protein 4	0.0325	0.2393	0.2393
Entamoeba histolytica	Sir2 family transcriptional regulator, putative	0.0135	0.0306	0.1073
Brugia malayi	Cyclin, N-terminal domain containing protein	0.03	0.211	0.2729
Loa Loa (eye worm)	AGC/NDR protein kinase	0.025	0.1566	0.1697
Entamoeba histolytica	cyclin, putative	0.0182	0.0822	0.2882
Loa Loa (eye worm)	hypothetical protein	0.0235	0.1397	0.1514
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0254	0.1614	0.1749
Brugia malayi	diacylglycerol kinase	0.0187	0.0872	0.1128
Entamoeba histolytica	protein kinase, putative	0.025	0.1566	0.5489
Brugia malayi	Ras association domain family 1 isoform A	0.0187	0.0872	0.1128
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.025	0.1566	0.1566
Echinococcus multilocularis	enhancer of mRNA decapping protein 4	0.0325	0.2393	0.2393
Echinococcus granulosus	cyclins	0.0182	0.0822	0.0822
Loa Loa (eye worm)	hypothetical protein	0.0699	0.6487	0.7029
Plasmodium vivax	cAMP-dependent protein kinase catalytic subunit, putative	0.0339	0.2543	1
Trypanosoma brucei	cAMP-dependent protein kinase catalytic subunit 1	0.0339	0.2543	1
Echinococcus multilocularis	Diacylglycerol kinase theta	0.0187	0.0872	0.0872
Entamoeba histolytica	diacylglycerol kinase, putative	0.0187	0.0872	0.3058
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0235	0.1397	0.1807
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.0187	0.0872	0.0872
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 3	0.0339	0.2543	1
Brugia malayi	diacylglycerol kinase	0.0187	0.0872	0.1128
Schistosoma mansoni	serine/threonine protein kinase	0.1019	1	1
Echinococcus granulosus	serine:threonine protein kinase N2	0.0363	0.2806	0.2806
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Schistosoma mansoni	rac gtpase activating protein	0.0187	0.0872	0.0872
Brugia malayi	Protein kinase c protein 2	0.0783	0.7408	0.9581
Trypanosoma cruzi	cyclin 6, putative	0.0235	0.1397	0.5494
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0599	0.5397	0.5397
Loa Loa (eye worm)	hypothetical protein	0.0129	0.0234	0.0254
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.025	0.1566	0.1566
Echinococcus granulosus	NDR protein kinase	0.025	0.1566	0.1566
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Trypanosoma brucei	Silent information regulator 2 related protein 1	0.0135	0.0306	0.1204
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.0181	0.0815	0.1256
Echinococcus multilocularis	cyclin B	0.0235	0.1397	0.1397
Echinococcus granulosus	cyclin b3	0.0182	0.0822	0.0822
Echinococcus multilocularis	cyclin b3	0.0182	0.0822	0.0822
Echinococcus multilocularis	RNA directed DNA polymerase	0.0556	0.4923	0.4923
Trichomonas vaginalis	AGC family protein kinase	0.0339	0.2543	1
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase subunit type II alpha	0.0335	0.2496	0.2705
Trichomonas vaginalis	cyclins, putative	0.0235	0.1397	0.5494
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.02	0.1022	0.1022
Brugia malayi	Protein kinase domain containing protein	0.025	0.1566	0.2026
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.0181	0.0815	0.1053
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0394	0.3145	0.3145
Schistosoma mansoni	vav2	0.0191	0.092	0.092
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.025	0.1566	0.1697
Loa Loa (eye worm)	raf kinase	0.0187	0.0872	0.0945
Loa Loa (eye worm)	hypothetical protein	0.0556	0.4923	0.5335
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.0187	0.0872	0.0945
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.0181	0.0815	0.0815
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 1	0.015	0.0475	0.0475
Schistosoma mansoni	atypical protein kinase C	0.0681	0.6291	0.6291
Trichomonas vaginalis	cyclin B3, putative	0.0182	0.0822	0.3233
Giardia lamblia	Cyclin A	0.0182	0.0822	0.3233
Loa Loa (eye worm)	AGC/PKN protein kinase	0.025	0.1566	0.1697
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0181	0.0815	0.0883
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0187	0.0872	0.0872
Schistosoma mansoni	serine/threonine protein kinase	0.1019	1	1
Giardia lamblia	G2/mitotic-specific cyclin B	0.0235	0.1397	0.5494
Loa Loa (eye worm)	hypothetical protein	0.0116	0.0093	0.0101
Trichomonas vaginalis	cyclin B, putative	0.0182	0.0822	0.3233
Brugia malayi	p70 ribosomal S6 kinase beta	0.025	0.1566	0.2026
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Trichomonas vaginalis	AGC family protein kinase	0.025	0.1566	0.6159
Echinococcus multilocularis	NAD dependent deacetylase sirtuin 3	0.0135	0.0306	0.0306
Entamoeba histolytica	Sir2 family transcriptional regulator, putative	0.0135	0.0306	0.1073
Trichomonas vaginalis	cyclin D, putative	0.0182	0.0822	0.3233
Brugia malayi	RhoGAP domain containing protein	0.0187	0.0872	0.1128
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Echinococcus granulosus	protein kinase c iota type	0.0664	0.6108	0.6108
Trichomonas vaginalis	AGC family protein kinase	0.025	0.1566	0.6159
Echinococcus multilocularis	serine:threonine protein kinase N2	0.025	0.1566	0.1566
Brugia malayi	protein kinase C3,putative	0.0428	0.3516	0.4548
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.025	0.1566	0.1566
Schistosoma mansoni	protein kinase C	0.0213	0.116	0.116
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.0235	0.1397	0.5494
Schistosoma mansoni	chromatin regulatory protein sir2	0.015	0.0475	0.0475
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0135	0.0306	0.1204
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0254	0.1614	0.6346
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.025	0.1566	0.1697
Echinococcus granulosus	cyclins	0.0182	0.0822	0.0822
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0335	0.2496	0.3228
Echinococcus granulosus	protein kinase C gamma type	0.0832	0.7952	0.7952
Echinococcus multilocularis	N chimaerin	0.0187	0.0872	0.0872
Trypanosoma cruzi	CYC2-like cyclin, putative	0.0235	0.1397	0.5494
Schistosoma mansoni	serine/threonine protein kinase	0.0339	0.2543	0.2543
Entamoeba histolytica	diacylglycerol kinase, putative	0.0187	0.0872	0.3058
Loa Loa (eye worm)	hypothetical protein	0.0743	0.6971	0.7554
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0187	0.0872	0.0945
Schistosoma mansoni	unc-13 (munc13)	0.0213	0.116	0.116
Echinococcus multilocularis	protein kinase c eta type	0.0187	0.0872	0.0872
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.0329	0.2432	0.2635
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0526	0.4596	0.5944
Schistosoma mansoni	serine/threonine protein kinase	0.0812	0.7732	0.7732
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.0596	0.5361	0.5809
Echinococcus granulosus	cyclins	0.0182	0.0822	0.0822
Schistosoma mansoni	cyclin B	0.0235	0.1397	0.1397
Echinococcus multilocularis	myotubularin protein 13	0.0191	0.092	0.092
Giardia lamblia	Kinase, AGC PKA	0.0339	0.2543	1
Brugia malayi	Protein kinase domain containing protein	0.02	0.1022	0.1322
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.1019	1	1
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.02	0.1022	0.1022
Echinococcus multilocularis	serine:threonine protein kinase 38	0.025	0.1566	0.1566
Entamoeba histolytica	protein kinase, putative	0.0254	0.1614	0.5656
Loa Loa (eye worm)	hypothetical protein	0.0191	0.092	0.0997
Giardia lamblia	Hypothetical protein	0.0135	0.0306	0.1204
Echinococcus multilocularis	C2 calcium dependent membrane targeting	0.0213	0.116	0.116
Echinococcus granulosus	myotubularin protein 13	0.0191	0.092	0.092
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0872	0.0945
Loa Loa (eye worm)	cyclin domain-containing protein	0.0526	0.4596	0.498
Echinococcus granulosus	serine:threonine protein kinase N2	0.025	0.1566	0.1566
Schistosoma mansoni	serine/threonine protein kinase	0.025	0.1566	0.1566
Trypanosoma cruzi	Silent information regulator 2 related protein 1	0.0135	0.0306	0.1204
Schistosoma mansoni	serine/threonine protein kinase	0.025	0.1566	0.1566
Leishmania major	protein kinase A catalytic subunit isoform 1	0.0339	0.2543	1
Onchocerca volvulus		0.032	0.233	0.3591
Toxoplasma gondii	hypothetical protein	0.0138	0.034	0.1338
Loa Loa (eye worm)	hypothetical protein	0.0315	0.2282	0.2473
Loa Loa (eye worm)	hypothetical protein	0.032	0.233	0.2524
Trypanosoma cruzi	Silent information regulator 2 related protein 1	0.0135	0.0306	0.1204
Schistosoma mansoni	protein kinase	0.0394	0.3145	0.3145
Schistosoma mansoni	protein kinase	0.0394	0.3145	0.3145
Schistosoma mansoni	serine/threonine protein kinase	0.025	0.1566	0.1566
Brugia malayi	RhoGEF domain containing protein	0.0187	0.0872	0.1128
Brugia malayi	Protein kinase domain containing protein	0.025	0.1566	0.2026
Plasmodium falciparum	cyclin	0.0182	0.0822	0.3233
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0181	0.0815	0.0883
Schistosoma mansoni	chromatin regulatory protein sir2	0.0135	0.0306	0.0306
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.025	0.1566	0.1566
Loa Loa (eye worm)	AGC/PKC/IOTA protein kinase	0.0444	0.3699	0.4009
Brugia malayi	Variant SH3 domain containing protein	0.0187	0.0872	0.1128
Loa Loa (eye worm)	hypothetical protein	0.0948	0.9228	1
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.015	0.0475	0.1868
Loa Loa (eye worm)	AGC/PKA protein kinase	0.0339	0.2543	0.2756
Loa Loa (eye worm)	AGC/PKA protein kinase	0.0339	0.2543	0.2756
Echinococcus granulosus	NAD dependent deacetylase sirtuin 1	0.015	0.0475	0.0475
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.03	0.211	0.211
Schistosoma mansoni	diacylglycerol kinase theta	0.0187	0.0872	0.0872
Schistosoma mansoni	serine/threonine protein kinase	0.0181	0.0815	0.0815
Trichomonas vaginalis	cyclin B, putative	0.0235	0.1397	0.5494
Loa Loa (eye worm)	cyclin domain-containing protein	0.03	0.211	0.2287
Trichomonas vaginalis	AGC family protein kinase	0.025	0.1566	0.6159
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Schistosoma mansoni	protein kinase	0.0394	0.3145	0.3145
Echinococcus multilocularis	cyclins	0.0182	0.0822	0.0822
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0343	0.259	0.9079
Echinococcus granulosus	cyclins	0.0182	0.0822	0.0822
Leishmania major	cyclin	0.0235	0.1397	0.5494
Trypanosoma brucei	protein kinase A catalytic subunit, putative	0.0339	0.2543	1
Schistosoma mansoni	serine/threonine protein kinase	0.02	0.1022	0.1022
Loa Loa (eye worm)	transcriptional regulator	0.0135	0.0306	0.0332
Echinococcus granulosus	C2 calcium dependent membrane targeting	0.0213	0.116	0.116
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.0181	0.0815	0.0815
Onchocerca volvulus		0.0235	0.1397	0.2154
Schistosoma mansoni	protein kinase C mu	0.0329	0.2432	0.2432
Brugia malayi	Pleckstrin Homology Domain	0.0191	0.092	0.119
Trichomonas vaginalis	AGC family protein kinase	0.0254	0.1614	0.6346
Trichomonas vaginalis	chromatin regulatory protein sir2, putative	0.0135	0.0306	0.1204
Schistosoma mansoni	serine/threonine protein kinase	0.0187	0.0872	0.0872
Schistosoma mansoni	unc-13 (munc13)	0.0213	0.116	0.116
Echinococcus multilocularis	Rac GTPase activating protein 1	0.0187	0.0872	0.0872
Loa Loa (eye worm)	hypothetical protein	0.0699	0.6487	0.7029
Entamoeba histolytica	protein kinase, putative	0.0254	0.1614	0.5656
Trichomonas vaginalis	cyclin B, putative	0.0235	0.1397	0.5494
Trypanosoma cruzi	cyclin, putative	0.0235	0.1397	0.5494
Entamoeba histolytica	cyclin family protein	0.0182	0.0822	0.2882
Schistosoma mansoni	serine/threonine protein kinase	0.0339	0.2543	0.2543
Trichomonas vaginalis	cyclins, putative	0.0235	0.1397	0.5494
Loa Loa (eye worm)	hypothetical protein	0.0213	0.116	0.1257
Schistosoma mansoni	chromatin regulatory protein sir2	0.0135	0.0306	0.0306
Echinococcus granulosus	Diacylglycerol kinase theta	0.0187	0.0872	0.0872
Echinococcus multilocularis	protein kinase c iota type	0.0664	0.6108	0.6108
Echinococcus multilocularis	serine threonine protein kinase	0.0832	0.7952	0.7952
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.0142	0.0384	0.0416
Plasmodium falciparum	cAMP-dependent protein kinase catalytic subunit	0.0339	0.2543	1
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.0187	0.0872	0.0872
Brugia malayi	Phorbol esters/diacylglycerol binding domain	0.0329	0.2432	0.3145
Echinococcus granulosus	protein kinase c epsilon type	0.0812	0.7732	0.7732
Leishmania major	protein kinase A catalytic subunit isoform 2	0.0339	0.2543	1
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0187	0.0872	0.0872
Trichomonas vaginalis	cyclins, putative	0.0235	0.1397	0.5494
Onchocerca volvulus		0.0315	0.2282	0.3518
Trichomonas vaginalis	conserved hypothetical protein	0.0182	0.0822	0.3233
Loa Loa (eye worm)	hypothetical protein	0.015	0.0475	0.0515
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.025	0.1566	0.1697
Toxoplasma gondii	AGC kinase	0.0339	0.2543	1
Echinococcus granulosus	raf serine:threonine protein kinase	0.0187	0.0872	0.0872
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0339	0.2543	0.2543
Brugia malayi	RhoGAP domain containing protein	0.0187	0.0872	0.1128
Echinococcus granulosus	RNA directed DNA polymerase	0.0556	0.4923	0.4923
Brugia malayi	transcriptional regulator, Sir2 family protein	0.0135	0.0306	0.0396
Echinococcus multilocularis	unc 13 (munc13)	0.0213	0.116	0.116

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 158 uM	Inhibition of human CD38 catalytic domain assessed as reduction in cADPR hydrolysis incubated for 10 mins by fluorimetric cycling assay	ChEMBL.	25226087

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.

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External resources for this compound

ChEMBL: CHEMBL3342441

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 935557