TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 459.515 | Formula: C26H26FN5O2
H donors: 3 H acceptors: 4 LogP: 4.3 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O[C@@H]1CC[C@H](CC1)Nc1nc2ccc(cc2n2c1ncc2)C(=O)NC1(CC1)c1ccc(cc1)F
InChi: 1S/C26H26FN5O2/c27-18-4-2-17(3-5-18)26(11-12-26)31-25(34)16-1-10-21-22(15-16)32-14-13-28-24(32)23(30-21)29-19-6-8-20(33)9-7-19/h1-5,10,13-15,19-20,33H,6-9,11-12H2,(H,29,30)(H,31,34)/t19-,20-
InChiKey: MFJOWCFANZXQBU-MXVIHJGJSA-N

Network

Hover on a compound node to display the structore

Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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

Clustering layers

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

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	microtubule associated serine/threonine kinase 3	Starlite/ChEMBL	References
Homo sapiens	mitogen-activated protein kinase 8	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Echinococcus granulosus	c-Jun N-terminal kinases	Get druggable targets OG5_129677	All targets in OG5_129677
Echinococcus granulosus	Microtubule-associated serine/threonine-protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_129677	All targets in OG5_129677
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127530	All targets in OG5_127530
Entamoeba histolytica	hypothetical protein	Get druggable targets OG5_127530	All targets in OG5_127530
Echinococcus multilocularis	serine:threonine protein kinase greatwall	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	serine/threonine-protein kinase, putative	Get druggable targets OG5_127530	All targets in OG5_127530
Schistosoma japonicum	IPR000164,Histone H3;IPR009072,Histone-fold,domain-containing	Get druggable targets OG5_129677	All targets in OG5_129677
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Echinococcus multilocularis	microtubule associated serine:threonine protein	Get druggable targets OG5_127530	All targets in OG5_127530
Loa Loa (eye worm)	CMGC/MAPK/JNK protein kinase	Get druggable targets OG5_129677	All targets in OG5_129677
Loa Loa (eye worm)	AGC/MAST/MAST protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Brugia malayi	KIAA0303	Get druggable targets OG5_127530	All targets in OG5_127530
Schistosoma japonicum	ko:K04440 c-Jun N-terminal kinase, putative	Get druggable targets OG5_129677	All targets in OG5_129677
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Echinococcus multilocularis	c Jun NH2 terminal kinase	Get druggable targets OG5_129677	All targets in OG5_129677
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Trichomonas vaginalis	AGC family protein kinase	Get druggable targets OG5_127530	All targets in OG5_127530
Brugia malayi	Stress-activated protein kinase jnk-1	Get druggable targets OG5_129677	All targets in OG5_129677

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
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Onchocerca volvulus		0.0437	0.5257	1
Brugia malayi	microtubule-associated serine/threonine protein kinase 2 (MAST2)	0.0097	0.11	0.1075
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Schistosoma mansoni	hypothetical protein	0.0016	0.0121	0.0113
Echinococcus granulosus	c-Jun N-terminal kinases	0.0281	0.3346	0.3341
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.006	0.0659	0.5
Mycobacterium ulcerans	aldehyde dehydrogenase	0.006	0.0659	0.5
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.006	0.0659	0.0651
Brugia malayi	KIAA0303	0.0031	0.0296	0.0269
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0029	0.0021
Schistosoma mansoni	aldehyde dehydrogenase	0.006	0.0659	0.0651
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0052	0.055	0.0525
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0121	0.0113
Echinococcus granulosus	GPCR family 2	0.0016	0.0121	0.0113
Schistosoma mansoni	hypothetical protein	0.0167	0.1963	0.1957
Schistosoma mansoni	hypothetical protein	0.0035	0.0351	0.0344
Brugia malayi	latrophilin 2 splice variant baaae	0.0035	0.0351	0.0325
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0655	0.0648
Brugia malayi	hypothetical protein	0.0121	0.1397	0.1374
Echinococcus multilocularis	dnaJ subfamily B	0.0404	0.4849	0.4845
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0121	0.0113
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0029	0.0021
Entamoeba histolytica	hypothetical protein	0.0031	0.0296	0.5
Brugia malayi	Stress-activated protein kinase jnk-1	0.0281	0.3346	0.3328
Echinococcus granulosus	Microtubule-associated serine/threonine-protein kinase	0.0127	0.1474	0.1467
Schistosoma mansoni	lozenge	0.0055	0.0591	0.0584
Schistosoma mansoni	cpg binding protein	0.003	0.0287	0.028
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0268	0.0241
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Echinococcus granulosus	cpg binding protein	0.003	0.0287	0.028
Schistosoma mansoni	hypothetical protein	0.0016	0.0121	0.0113
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0121	0.0092
Loa Loa (eye worm)	CMGC/MAPK/JNK protein kinase	0.0281	0.3346	0.3327
Schistosoma mansoni	aldehyde dehydrogenase	0.006	0.0659	0.0651
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Toxoplasma gondii	aldehyde dehydrogenase	0.006	0.0659	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.1397	0.1373
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Schistosoma mansoni	serine/threonine protein kinase	0.0097	0.1105	0.1098
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0052	0.055	0.0523
Echinococcus multilocularis	geminin	0.0167	0.1963	0.1957
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0121	0.0094
Schistosoma mansoni	hypothetical protein	0.0404	0.4849	0.4845
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0121	0.0113
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0268	0.024
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.006	0.0659	0.0651
Schistosoma mansoni	hypothetical protein	0.0016	0.0121	0.0113
Echinococcus multilocularis	serine:threonine protein kinase greatwall	0.0031	0.0296	0.0288
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0121	0.0092
Onchocerca volvulus	Huntingtin homolog	0.0121	0.1397	0.2264
Schistosoma mansoni	cpg binding protein	0.0028	0.0268	0.026
Loa Loa (eye worm)	hypothetical protein	0.0437	0.5257	0.5243
Mycobacterium ulcerans	aldehyde dehydrogenase	0.006	0.0659	0.5
Onchocerca volvulus	Huntingtin homolog	0.0121	0.1397	0.2264
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.0296	0.0288
Echinococcus multilocularis	Protein lozenge	0.0055	0.0591	0.0584
Echinococcus multilocularis	c Jun NH2 terminal kinase	0.0281	0.3346	0.3341
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.055	0.0523
Echinococcus multilocularis	cpg binding protein	0.003	0.0287	0.028
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0121	0.0094
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0351	0.0324
Schistosoma mansoni	hypothetical protein	0.0167	0.1963	0.1957
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0052	0.055	0.0525
Schistosoma mansoni	cpg binding protein	0.003	0.0287	0.028
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0121	0.0113
Schistosoma mansoni	hypothetical protein	0.0016	0.0121	0.0113
Brugia malayi	Serine/threonine-protein kinase SULU	0.0826	1	1
Brugia malayi	hypothetical protein	0.0437	0.5257	0.5244
Schistosoma mansoni	serine/threonine protein kinase	0.0826	1	1
Loa Loa (eye worm)	STE/STE20/TAO protein kinase	0.0826	1	1
Echinococcus granulosus	dnaJ subfamily B	0.0404	0.4849	0.4845
Echinococcus granulosus	geminin	0.0167	0.1963	0.1957
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.006	0.0659	0.5
Loa Loa (eye worm)	runx1	0.0055	0.0591	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0121	0.1397	0.1373
Mycobacterium ulcerans	aldehyde dehydrogenase	0.006	0.0659	0.5
Echinococcus multilocularis	microtubule associated serine:threonine protein	0.0127	0.1474	0.1467
Entamoeba histolytica	protein kinase, putative	0.0031	0.0296	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0281	0.3346	0.3341
Echinococcus granulosus	serine:threonine protein kinase TAO1	0.0826	1	1
Loa Loa (eye worm)	hypothetical protein	0.0437	0.5257	0.5243
Loa Loa (eye worm)	AGC/MAST/MAST protein kinase	0.0127	0.1474	0.1449
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0121	0.0113
Echinococcus multilocularis	serine:threonine protein kinase TAO1	0.0826	1	1
Trichomonas vaginalis	serine/threonine-protein kinase, putative	0.0028	0.0261	0.8824
Trichomonas vaginalis	AGC family protein kinase	0.0031	0.0296	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 41 nM	Inhibition of JNK1 in human Jurkat cell lysates using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
IC50 (binding)	= 0.16 uM	Inhibition of human recombinant histidine-tagged full-length JNK1 expressed in insect cells using GST-tagged MAP2K7 as substrate after 1 hr by luminescence plate reader analysis	ChEMBL.	23916259
IC50 (binding)	= 0.74 uM	Inhibition of MAST3 in human HuH7 cell lysates	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PI4KA/PI4KAP2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PEK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PCTAIRE1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of p38delta/gamma in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of GCN2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CK1alpha in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PRPK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PFTAIRE1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PIP4K2C in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PI4KB in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of GSK3beta in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK9 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK10 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of ZAK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of Wnk4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of Wnk2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of Wnk1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of TLK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of TLK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of TAO3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of TAO1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of SRPK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of SRPK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of SNRK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of SLK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of RSK2 domain2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of RON in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of ROCK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of ROCK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PRP4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PKR in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PKCbeta in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PKCalpha in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PHKgamma2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PDK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of p70S6Kbeta in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of p70S6K in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of p38beta in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of p38alpha in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of NEK9 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of NEK8 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of NEK7 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of NEK6 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of NDR2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of YSK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MST4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MST2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MST1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MRCKbeta in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MLK3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MET in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MARK4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MARK3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MARK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP3K4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP3K3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP3K2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP2K6 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP2K4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP2K3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP2K2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MAP2K1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of LOK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of IRAK4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of IRAK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of ILK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of YES in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of SRC in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of FYN in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of FER in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of FAK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of Erk2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of Erk1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EphB4 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EphB2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EphA7 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EphA2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EphA1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of EGFR in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of eEF2K in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of DNAPK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CSK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CLK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK5 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK8 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CDK11 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CASK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of ATR in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of AGK in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PIK3CB in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of IKKepsilon/TBK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of MPSK1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of LKB1 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CK2alpha2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CHK2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CaMK2gamma in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of CaMK2alpha/CaMK2beta/CaMK2delta/CaMK2gamma in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of AMPKalpha1/AMPKalpha2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of TAO2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	< 35 %	Inhibition of PKD2 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	= 44.3 %	Inhibition of CK1delta/CK1epsilon in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	= 76 %	Inhibition of MAST1/2 in human HuH7 cell lysates at 10 uM	ChEMBL.	23916259
Inhibition (binding)	= 78.7 %	Inhibition of MAST4 in human HuH7 cell lysates at 10 uM	ChEMBL.	23916259
Inhibition (binding)	= 93.1 %	Inhibition of MAST3 in human HuH7 cell lysates at 10 uM	ChEMBL.	23916259
Inhibition (binding)	= 97.6 %	Inhibition of MAST3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259
Inhibition (binding)	= 98.7 %	Inhibition of JNK1/JNK2/JNK3 in human PC3 cell lysates at 10 uM using desthiobiotin-tagged ATP probe AX9989 followed by trypsinization by LC/MS analysis	ChEMBL.	23916259

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: CHEMBL2420555

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1770220