TDR Targets

Basic information

Technical information

TDR Targets ID: 81255
Name: tert-butyl 4-[3-[4-(1-methylindol-3-yl)-2,5-d ioxopyrrol-3-yl]indol-1-yl]piperidine-1-carbo xylate
MW: 524.61 | Formula: C31H32N4O4
H donors: 1 H acceptors: 3 LogP: 4.07 Rotable bonds: 6
Rule of 5 violations (Lipinski): 2
SMILES: O=C(N1CCC(CC1)n1cc(c2c1cccc2)C1=C(C(=O)NC1=O)c1cn(c2c1cccc2)C)OC(C)(C)C
InChi: 1S/C31H32N4O4/c1-31(2,3)39-30(38)34-15-13-19(14-16-34)35-18-23(21-10-6-8-12-25(21)35)27-26(28(36)32-29(27)37)22-17-33(4)24-11-7-5-9-20(22)24/h5-12,17-19H,13-16H2,1-4H3,(H,32,36,37)
InChiKey: FZXZDHDSQPECTD-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

tert-butyl 4-[3-[4-(1-methylindol-3-yl)-2,5-dioxo-pyrrol-3-yl]indol-1-yl]piperidine-1-carboxylate
4-[3-[4-(1-methyl-3-indolyl)-2,5-dioxo-3-pyrrolyl]-1-indolyl]-1-piperidinecarboxylic acid tert-butyl ester
4-[3-[2,5-diketo-4-(1-methylindol-3-yl)-3-pyrrolin-3-yl]indol-1-yl]piperidine-1-carboxylic acid tert-butyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	protein kinase C, delta	Starlite/ChEMBL	References
Homo sapiens	protein kinase C, eta	Starlite/ChEMBL	References
Homo sapiens	protein kinase C, alpha	Starlite/ChEMBL	References
Homo sapiens	protein kinase C, epsilon	Starlite/ChEMBL	References
Homo sapiens	protein kinase C, gamma	Starlite/ChEMBL	References
Homo sapiens	protein kinase C, beta	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K06068 novel protein kinase C, putative	Get druggable targets OG5_129314	All targets in OG5_129314
Echinococcus multilocularis	telomerase reverse transcriptase subunit	Get druggable targets OG5_129482	All targets in OG5_129482
Schistosoma japonicum	Protein kinase C alpha type, putative	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus granulosus	Protein kinase C brain isozyme	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132502	All targets in OG5_132502
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132502	All targets in OG5_132502
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_129314	All targets in OG5_129314
Candida albicans	protein kinase C similar to S. cerevisiae PKC1 (YBL105C)	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus multilocularis	RNA directed DNA polymerase	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus granulosus	protein kinase c epsilon type	Get druggable targets OG5_129314	All targets in OG5_129314
Brugia malayi	protein kinase C II.	Get druggable targets OG5_129314	All targets in OG5_129314
Echinococcus multilocularis	Protein kinase C, brain isozyme	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus multilocularis	protein kinase c epsilon type	Get druggable targets OG5_129314	All targets in OG5_129314
Schistosoma japonicum	IPR000477,RNA-directed DNA polymerase (Reverse transcriptase),domain-containing	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus granulosus	serine:threonine protein kinase N2	Get druggable targets OG5_129314	All targets in OG5_129314
Schistosoma japonicum	Calcium-dependent protein kinase C, putative	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132502	All targets in OG5_132502
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132502	All targets in OG5_132502
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132502	All targets in OG5_132502
Onchocerca volvulus		Get druggable targets OG5_132502	All targets in OG5_132502
Schistosoma japonicum	Protein kinase C alpha type, putative	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus multilocularis	serine:threonine protein kinase N2	Get druggable targets OG5_129314	All targets in OG5_129314
Schistosoma japonicum	Protein kinase C gamma type, putative	Get druggable targets OG5_129482	All targets in OG5_129482
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus granulosus	RNA directed DNA polymerase	Get druggable targets OG5_129482	All targets in OG5_129482
Schistosoma japonicum	Protein kinase C epsilon type, putative	Get druggable targets OG5_129314	All targets in OG5_129314
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_129482	All targets in OG5_129482
Entamoeba histolytica	PH domain containing protein kinase, putative	Get druggable targets OG5_129314	All targets in OG5_129314
Echinococcus multilocularis	serine threonine protein kinase	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129482	All targets in OG5_129482
Echinococcus granulosus	protein kinase C gamma type	Get druggable targets OG5_129482	All targets in OG5_129482
Candida albicans	protein kinase C similar to S. cerevisiae PKC1 (YBL105C)	Get druggable targets OG5_129482	All targets in OG5_129482
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	Get druggable targets OG5_129314	All targets in OG5_129314
Brugia malayi	Protein kinase c protein 2	Get druggable targets OG5_129482	All targets in OG5_129482

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
Leishmania major	hypothetical protein, conserved	0.0043	0.0095	0.2804
Toxoplasma gondii	AGC kinase	0.0065	0.0336	0.9887
Mycobacterium leprae	conserved hypothetical protein	0.0043	0.0095	0.5
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.034	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0163	0.144	0.144
Brugia malayi	Pleckstrin Homology Domain	0.0046	0.0123	0.0233
Brugia malayi	C1-like domain containing protein	0.0047	0.0139	0.0263
Schistosoma mansoni	unc-13 (munc13)	0.0053	0.0208	0.0743
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0168	0.1499	1
Echinococcus granulosus	protein kinase c eta type	0.0046	0.0123	0.0297
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0231	0.2208	0.2208
Schistosoma mansoni	lozenge	0.0063	0.0323	0.115
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0065	0.0336	0.0635
Echinococcus granulosus	Diacylglycerol kinase theta	0.0046	0.0123	0.0297
Onchocerca volvulus		0.0505	0.5286	1
Schistosoma mansoni	ets-related	0.0251	0.2428	0.8653
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Schistosoma mansoni	thyroid hormone receptor	0.0163	0.144	0.5134
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Schistosoma mansoni	rac gtpase activating protein	0.0046	0.0123	0.044
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0065	0.0336	0.0336
Schistosoma mansoni	jumonji/arid domain-containing protein	0.013	0.107	0.3814
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0065	0.0336	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0208	0.0394
Echinococcus multilocularis	unc 13 (munc13)	0.0053	0.0208	0.0208
Schistosoma mansoni	aldehyde dehydrogenase	0.0065	0.034	0.121
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0065	0.034	0.034
Brugia malayi	RhoGAP domain containing protein	0.0046	0.0123	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0167	0.1483	0.2806
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Brugia malayi	Protein kinase domain containing protein	0.0065	0.0336	0.0635
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0095	0.0229
Brugia malayi	RhoGEF domain containing protein	0.0046	0.0123	0.0233
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0065	0.0336	0.0808
Schistosoma mansoni	diacylglycerol kinase theta	0.0046	0.0123	0.044
Schistosoma mansoni	hypothetical protein	0.0203	0.189	0.6738
Echinococcus granulosus	unc 13 munc13	0.0053	0.0208	0.0502
Echinococcus multilocularis	C2 calcium dependent membrane targeting	0.0053	0.0208	0.0208
Echinococcus granulosus	C2 calcium dependent membrane targeting	0.0053	0.0208	0.0502
Brugia malayi	Ets-domain containing protein	0.0083	0.0539	0.1019
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0065	0.034	0.0817
Schistosoma mansoni	gabp alpha	0.0083	0.0539	0.192
Schistosoma mansoni	aldehyde dehydrogenase	0.0065	0.034	0.121
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0035	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0191	0.046
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.034	1
Echinococcus multilocularis	protein kinase c eta type	0.0046	0.0123	0.0123
Onchocerca volvulus		0.0059	0.0276	0.0349
Echinococcus granulosus	protein kinase c iota type	0.011	0.0848	0.2041
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0065	0.034	1
Echinococcus granulosus	GA binding protein alpha chain	0.0083	0.0539	0.1296
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Brugia malayi	Protein kinase c protein 2	0.0197	0.1829	0.346
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0065	0.0336	0.0635
Schistosoma mansoni	cellular tumor antigen P53	0.0059	0.0276	0.0984
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0191	0.0681
Loa Loa (eye worm)	cytochrome P450 family protein	0.0055	0.0227	0.0429
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0063	0.032	0.935
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0139	0.0495
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0151	0.1304	0.1304
Echinococcus granulosus	raf serine:threonine protein kinase	0.0046	0.0123	0.0297
Loa Loa (eye worm)	hypothetical protein	0.0167	0.1483	0.2806
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0275	0.2705	1
Loa Loa (eye worm)	fli-1 protein	0.0251	0.2428	0.4593
Echinococcus multilocularis	tumor protein p63	0.0405	0.4156	0.4156
Onchocerca volvulus		0.0167	0.1483	0.2674
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Mycobacterium leprae	Probable lipase LipE	0.0043	0.0095	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0065	0.0336	0.1196
Echinococcus granulosus	serine:threonine protein kinase N2	0.0065	0.0336	0.0808
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Brugia malayi	jmjC domain containing protein	0.013	0.107	0.2025
Schistosoma mansoni	serine/threonine protein kinase	0.0065	0.0336	0.1196
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Brugia malayi	Ras association domain family 1 isoform A	0.0046	0.0123	0.0233
Brugia malayi	diacylglycerol kinase	0.0046	0.0123	0.0233
Schistosoma mansoni	protein kinase C mu	0.0047	0.0139	0.0495
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0065	0.0336	0.0336
Brugia malayi	Cytochrome P450 family protein	0.0055	0.0227	0.0429
Brugia malayi	RhoGAP domain containing protein	0.0046	0.0123	0.0233
Brugia malayi	hypothetical protein	0.0505	0.5286	1
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0065	0.0336	0.0808
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Schistosoma mansoni	hypothetical protein	0.0151	0.1304	0.4649
Echinococcus multilocularis	myotubularin protein 13	0.0046	0.0123	0.0123
Brugia malayi	diacylglycerol kinase	0.0046	0.0123	0.0233
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0046	0.0123	0.0123
Schistosoma mansoni	protein kinase C mu	0.0046	0.0123	0.044
Echinococcus granulosus	Protein kinase C brain isozyme	0.0261	0.2538	0.6106
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.0047	0.0139	0.0334
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0261	0.2538	0.2538
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.0046	0.0123	0.0233
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0191	0.0191
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0065	0.0336	0.0635
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0095	1
Echinococcus granulosus	NDR protein kinase	0.0065	0.0336	0.0808
Echinococcus granulosus	tumor protein p63	0.0405	0.4156	1
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.013	0.107	0.107
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0095	1
Brugia malayi	jmjC domain containing protein	0.013	0.107	0.2025
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Echinococcus multilocularis	serine threonine protein kinase	0.0215	0.2026	0.2026
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.0047	0.0139	0.0263
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Echinococcus multilocularis	geminin	0.0203	0.189	0.189
Echinococcus granulosus	Rac GTPase activating protein 1	0.0046	0.0123	0.0297
Brugia malayi	Protein kinase domain containing protein	0.0065	0.0336	0.0635
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.034	1
Onchocerca volvulus		0.0046	0.0123	0.0054
Schistosoma mansoni	serine/threonine protein kinase	0.0284	0.2806	1
Schistosoma mansoni	hypothetical protein	0.0203	0.189	0.6738
Loa Loa (eye worm)	RasGEF domain-containing protein	0.0046	0.0123	0.0233
Schistosoma mansoni	hypothetical protein	0.0046	0.0123	0.044
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.0047	0.0139	0.0139
Echinococcus granulosus	N chimaerin	0.0046	0.0123	0.0297
Echinococcus granulosus	serine:threonine protein kinase N2	0.0168	0.1499	0.3606
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Schistosoma mansoni	serine/threonine kinase	0.0065	0.0336	0.1196
Entamoeba histolytica	protein kinase, putative	0.0065	0.0336	0.1544
Schistosoma mansoni	diacylglycerol kinase theta	0.0046	0.0123	0.044
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.0046	0.0123	0.0123
Schistosoma mansoni	serine/threonine protein kinase	0.0065	0.0336	0.1196
Loa Loa (eye worm)	D-ets-4 DNA binding domain-containing protein	0.0083	0.0539	0.1019
Toxoplasma gondii	diacylglycerol kinase, putative	0.0046	0.0123	0.3633
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Echinococcus multilocularis	Rac GTPase activating protein 1	0.0046	0.0123	0.0123
Echinococcus multilocularis	Protein lozenge	0.0063	0.0323	0.0323
Toxoplasma gondii	aldehyde dehydrogenase	0.0065	0.034	1
Brugia malayi	beta-lactamase family protein	0.0043	0.0095	0.018
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0191	0.0681
Schistosoma mansoni	protein kinase C	0.0053	0.0208	0.0743
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0065	0.0336	0.0808
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0095	0.0095
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0065	0.0336	0.0635
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0139	0.0495
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0065	0.0336	0.0336
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0065	0.0336	1
Schistosoma mansoni	jumonji/arid domain-containing protein	0.013	0.107	0.3814
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.0046	0.0123	0.0297
Echinococcus multilocularis	N chimaerin	0.0046	0.0123	0.0123
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.013	0.107	0.2575
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.0152	0.1316	0.2491
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0191	0.0191
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0276	0.0523
Brugia malayi	p70 ribosomal S6 kinase beta	0.0065	0.0336	0.0635
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0095	0.0339
Loa Loa (eye worm)	hypothetical protein	0.0167	0.1483	0.2806
Loa Loa (eye worm)	hypothetical protein	0.0143	0.1216	0.23
Loa Loa (eye worm)	hypothetical protein	0.0505	0.5286	1
Brugia malayi	beta-lactamase	0.0043	0.0095	0.018
Brugia malayi	protein kinase C II.	0.0284	0.2806	0.5308
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0065	0.0336	0.0336
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0065	0.034	0.0936
Entamoeba histolytica	protein kinase, putative	0.0065	0.0336	0.1544
Toxoplasma gondii	ABC1 family protein	0.0043	0.0095	0.2804
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0143	0.1216	0.1216
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0404	0.0764
Brugia malayi	Hr1 repeat family protein	0.0065	0.0336	0.0635
Echinococcus multilocularis	GA binding protein alpha chain	0.0083	0.0539	0.0539
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0151	0.1304	0.3138
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.0095	0.018
Brugia malayi	Variant SH3 domain containing protein	0.0046	0.0123	0.0233
Loa Loa (eye worm)	Ras association domain family 1 isoform A	0.0046	0.0123	0.0233
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0052	0.0191	0.0361
Echinococcus multilocularis	protein kinase c epsilon type	0.0284	0.2806	0.2806
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Loa Loa (eye worm)	hypothetical protein	0.0188	0.1728	0.3269
Brugia malayi	Phorbol esters/diacylglycerol binding domain	0.0047	0.0139	0.0263
Loa Loa (eye worm)	runx1	0.0063	0.0323	0.0611
Brugia malayi	Protein kinase domain containing protein	0.0047	0.0139	0.0263
Echinococcus granulosus	myotubularin protein 13	0.0046	0.0123	0.0297
Loa Loa (eye worm)	jmjC domain-containing protein	0.013	0.107	0.2025
Echinococcus multilocularis	lysine specific demethylase 5A	0.013	0.107	0.107
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0095	1
Brugia malayi	beta-lactamase family protein	0.0043	0.0095	0.018
Brugia malayi	protein kinase C3,putative	0.0047	0.0139	0.0263
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0065	0.0336	0.0635
Echinococcus multilocularis	RNA directed DNA polymerase	0.0143	0.1216	0.1216
Loa Loa (eye worm)	beta-lactamase	0.0043	0.0095	0.018
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0046	0.0123	0.0233
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0046	0.0123	0.044
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.0095	0.018
Echinococcus granulosus	geminin	0.0203	0.189	0.4548
Loa Loa (eye worm)	hypothetical protein	0.0212	0.1996	0.3776
Echinococcus multilocularis	protein kinase c iota type	0.011	0.0848	0.0848
Schistosoma mansoni	thyroid hormone receptor	0.0163	0.144	0.5134
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0095	0.2836
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0065	0.0336	0.0635
Loa Loa (eye worm)	raf kinase	0.0046	0.0123	0.0233
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0284	0.2806	0.5308
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0065	0.0336	0.0336
Entamoeba histolytica	protein kinase, putative	0.0065	0.0336	0.1544
Echinococcus granulosus	protein kinase C gamma type	0.0215	0.2026	0.4874
Schistosoma mansoni	serine/threonine protein kinase	0.0065	0.0336	0.1196
Onchocerca volvulus		0.0053	0.0208	0.0218
Schistosoma mansoni	serine/threonine protein kinase	0.0261	0.2538	0.9047
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Loa Loa (eye worm)	AGC/PKC/IOTA protein kinase	0.0047	0.0139	0.0263
Schistosoma mansoni	atypical protein kinase C	0.011	0.0848	0.3023
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0095	0.0339
Loa Loa (eye worm)	hypothetical protein	0.0505	0.5286	1
Schistosoma mansoni	vav2	0.0046	0.0123	0.044
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0052	0.0191	0.0361
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0046	0.0123	0.044
Echinococcus granulosus	lysine specific demethylase 5A	0.013	0.107	0.2575
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Onchocerca volvulus		0.0046	0.0123	0.0054
Schistosoma mansoni	jumonji domain containing protein	0.013	0.107	0.3814
Echinococcus granulosus	protein kinase c epsilon type	0.0284	0.2806	0.675
Loa Loa (eye worm)	hypothetical protein	0.0231	0.2208	0.4177
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0095	0.018
Brugia malayi	Fli-1 protein	0.0251	0.2428	0.4593
Schistosoma mansoni	serine/threonine protein kinase	0.0046	0.0123	0.044
Trichomonas vaginalis	AGC family protein kinase	0.0065	0.0336	1
Brugia malayi	Protein kinase domain containing protein	0.0065	0.0336	0.0635
Brugia malayi	Ets-domain containing protein	0.0083	0.0539	0.1019
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0191	0.046
Echinococcus granulosus	RNA directed DNA polymerase	0.0143	0.1216	0.2925
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0191	0.0681
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0123	0.0233
Entamoeba histolytica	protein kinase, putative	0.0065	0.0336	0.1544
Echinococcus multilocularis	Diacylglycerol kinase theta	0.0046	0.0123	0.0123
Schistosoma mansoni	serine/threonine protein kinase	0.0261	0.2538	0.9047
Schistosoma mansoni	unc-13 (munc13)	0.0053	0.0208	0.0743

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.08 uM	Inhibition of Protein kinase C beta 2	ChEMBL.	12749884
IC50 (binding)	= 0.08 uM	Inhibition of Protein kinase C beta 2	ChEMBL.	12749884
IC50 (binding)	= 0.2 uM	Inhibition of Protein kinase C beta 1	ChEMBL.	12749884
IC50 (binding)	= 0.2 uM	Inhibition of Protein kinase C beta 1	ChEMBL.	12749884
IC50 (binding)	= 5 uM	Inhibition of Protein kinase C gamma	ChEMBL.	12749884
IC50 (binding)	= 5 uM	Inhibition of Protein kinase C gamma	ChEMBL.	12749884
IC50 (binding)	= 6 uM	Inhibition of Protein kinase C alpha	ChEMBL.	12749884
IC50 (binding)	= 6 uM	Inhibition of Protein kinase C epsilon	ChEMBL.	12749884
IC50 (binding)	= 6 uM	Inhibition of Protein kinase C alpha	ChEMBL.	12749884
IC50 (binding)	= 6 uM	Inhibition of Protein kinase C epsilon	ChEMBL.	12749884
IC50 (binding)	= 7 uM	Inhibition of Protein kinase C delta	ChEMBL.	12749884
IC50 (binding)	= 7 uM	Inhibition of Protein kinase C delta	ChEMBL.	12749884
IC50 (binding)	= 8 uM	Inhibition of Protein kinase C eta	ChEMBL.	12749884
IC50 (binding)	= 8 uM	Inhibition of Protein kinase C eta	ChEMBL.	12749884
IC50 (binding)	> 100 uM	Inhibition of Protein kinase C zeta	ChEMBL.	12749884
IC50 (binding)	> 100 uM	Inhibition of Protein kinase C zeta	ChEMBL.	12749884

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: CHEMBL293805
PubChem: 10864309

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 81255