TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 642.668 | Formula: C28H40BrN3O5S2
H donors: 2 H acceptors: 4 LogP: 4.21 Rotable bonds: 17
Rule of 5 violations (Lipinski): 2
SMILES: CC(C[C@@H](C(=O)NC(C(=O)C(=O)N1CCOCC1)Cc1ccc(cc1)Br)NC(=O)CCCCC1SSCC1)C
InChi: 1S/C28H40BrN3O5S2/c1-19(2)17-24(30-25(33)6-4-3-5-22-11-16-38-39-22)27(35)31-23(18-20-7-9-21(29)10-8-20)26(34)28(36)32-12-14-37-15-13-32/h7-10,19,22-24H,3-6,11-18H2,1-2H3,(H,30,33)(H,31,35)/t22?,23?,24-/m0/s1
InChiKey: VCKGCCQMUHSLGO-VHYCJAOWSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Sus scrofa	Calpain 1		References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Calpain-1 catalytic subunit, putative	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma japonicum	ko:K08585 calpain, invertebrate, putative	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	calpain family protein 1, d	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus granulosus	calpain A	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Brugia malayi	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus granulosus	family C2 unassigned peptidase C02 family	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Brugia malayi	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Onchocerca volvulus		Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	calpain A	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma japonicum	Calpain-A, putative	Get druggable targets OG5_127139	All targets in OG5_127139

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus multilocularis	hypothetical protein	Calpain 1	714 aa	716 aa	33.1 %
Schistosoma mansoni	calpain (C02 family)	Calpain 1	714 aa	684 aa	31.0 %
Echinococcus multilocularis	calpain	Calpain 1	714 aa	695 aa	38.6 %
Schistosoma japonicum	Calpain-9, putative	Calpain 1	714 aa	671 aa	33.8 %
Echinococcus granulosus	calpain A	Calpain 1	714 aa	753 aa	31.5 %
Echinococcus granulosus	calpain	Calpain 1	714 aa	695 aa	38.6 %
Schistosoma mansoni	calpain C (C02 family)	Calpain 1	714 aa	715 aa	33.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Plasmodium falciparum	peptidase, putative	0.0014	0.0229	0.5311
Trypanosoma cruzi	hypothetical protein, conserved	0.0014	0.0229	0.0564
Trypanosoma cruzi	hypothetical protein, conserved	0.0014	0.0229	0.0564
Trypanosoma cruzi	oligopeptidase b	0.0052	0.1481	0.3651
Giardia lamblia	Sgs1 DNA helicase, putative	0.0009	0.0061	0.0234
Mycobacterium leprae	PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B)	0.0052	0.1481	0.5
Brugia malayi	calpain 7	0.002	0.0429	0.0931
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0011	0.0143	0.0353
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma brucei	calpain-like protein, putative	0.002	0.0429	0.1058
Schistosoma mansoni	calpain-7 (C02 family)	0.002	0.0429	0.0922
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Echinococcus granulosus	acylamino acid releasing enzyme	0.0014	0.0229	0.0564
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0061	0.001
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0014	0.0229	0.0421
Onchocerca volvulus	Prolyl endopeptidase homolog	0.0131	0.4058	1
Echinococcus granulosus	Dipeptidyl peptidase 9	0.0014	0.0229	0.0564
Leishmania major	dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B	0.0014	0.0229	0.0219
Plasmodium vivax	ADP-dependent DNA helicase RecQ, putative	0.0014	0.024	0.0543
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0131	0.4058	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0229	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0047	0.1306	0.1256
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Trichomonas vaginalis	Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase	0.0014	0.0229	0.4977
Plasmodium vivax	calpain, putative	0.002	0.0429	1
Toxoplasma gondii	prolyl endopeptidase	0.0131	0.4058	1
Loa Loa (eye worm)	prolyl oligopeptidase	0.0014	0.0229	0.0173
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Trypanosoma brucei	antigen, putative	0.002	0.0429	0.1058
Leishmania major	kinesin, putative	0.0014	0.0234	0.0232
Mycobacterium tuberculosis	Probable protease II PtrBb [second part] (oligopeptidase B)	0.0052	0.1481	0.2839
Toxoplasma gondii	dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein	0.0014	0.0229	0.0421
Echinococcus multilocularis	Dipeptidyl peptidase 9	0.0014	0.0229	0.0564
Brugia malayi	hypothetical protein	0.012	0.3702	0.911
Loa Loa (eye worm)	calpain 5	0.0014	0.0234	0.0179
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0053	0.1501	0.3604
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.1058
Schistosoma mansoni	calpain (C02 family)	0.002	0.0429	0.0922
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trichomonas vaginalis	Phosphoglycerol transferase I, putative	0.0008	0.0057	0.1233
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0009	0.0061	0.015
Trypanosoma cruzi	dipeptidyl-peptidase 8-like serine peptidase	0.0014	0.0229	0.0564
Trichomonas vaginalis	DNA helicase recq, putative	0.0011	0.0143	0.3116
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Entamoeba histolytica	dipeptidyl-peptidase, putative	0.0014	0.0229	0.9771
Brugia malayi	calpain 5	0.0014	0.0234	0.0444
Schistosoma mansoni	calpain C (C02 family)	0.002	0.0429	0.0922
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Onchocerca volvulus	Dipeptidyl peptidase family member 1 homolog	0.0014	0.0229	0.043
Entamoeba histolytica	calpain large subunit domain III containing protein	0.0014	0.0234	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0322	0.0267
Trypanosoma brucei	serine peptidase, clan SC, family S9A-like protein	0.0052	0.1481	0.3651
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Giardia lamblia	Alanyl dipeptidyl peptidase	0.0014	0.0229	1
Echinococcus multilocularis	bloom syndrome protein	0.0021	0.046	0.1133
Mycobacterium tuberculosis	Probable protease II PtrBa [first part] (oligopeptidase B)	0.0117	0.3609	0.708
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0014	0.0229	0.9771
Trypanosoma cruzi	oligopeptidase B-like protein, putative	0.0052	0.1481	0.3651
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma cruzi	kinesin, putative	0.0014	0.0234	0.0577
Entamoeba histolytica	recQ family helicase, putative	0.0011	0.0143	0.6117
Trypanosoma brucei	calpain-like protein, putative	0.002	0.0429	0.1058
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.1058
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0014	0.0229	0.9771
Echinococcus multilocularis	dipeptidyl aminopeptidaseprotein	0.0014	0.0229	0.0564
Leishmania major	oligopeptidase b	0.0052	0.1481	0.3418
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0009	0.0061	0.015
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.1058
Schistosoma mansoni	Mername-AA248 (C02 family)	0.002	0.0429	0.0922
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Brugia malayi	Bloom's syndrome protein homolog	0.0021	0.046	0.1007
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0229	0.4977
Trypanosoma brucei	prolyl endopeptidase	0.0131	0.4058	1
Echinococcus granulosus	calpain A	0.0055	0.1579	0.3891
Trypanosoma cruzi	serine peptidase, Clan SC, Family S9B	0.0014	0.0229	0.0564
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trichomonas vaginalis	DNA helicase recq, putative	0.0021	0.046	1
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0011	0.0143	0.0353
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Schistosoma mansoni	blooms syndrome DNA helicase	0.0016	0.0317	0.0641
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0009	0.0061	0.0004
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.0731
Schistosoma mansoni	subfamily S9B unassigned peptidase (S09 family)	0.0014	0.0229	0.0421
Schistosoma mansoni	hypothetical protein	0.005	0.1427	0.3419
Trypanosoma brucei	calpain-like protein, putative	0.002	0.0429	0.1058
Entamoeba histolytica	hypothetical protein, conserved	0.0014	0.0229	0.9771
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0009	0.0061	0.015
Mycobacterium tuberculosis	Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase)	0.0162	0.5074	1
Echinococcus granulosus	calpain A	0.002	0.0429	0.1058
Loa Loa (eye worm)	hypothetical protein	0.0039	0.1047	0.0996
Entamoeba histolytica	protein kinase, putative	0.0014	0.0234	1
Loa Loa (eye worm)	calpain family protein 1	0.0053	0.1501	0.1453
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0055	0.1579	0.3799
Trypanosoma brucei	oligopeptidase b	0.0052	0.1481	0.3651
Echinococcus multilocularis	calpain	0.002	0.0429	0.1058
Echinococcus granulosus	calpain 7 C02 family	0.002	0.0429	0.1058
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Onchocerca volvulus		0.0033	0.0852	0.1988
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.0055	0.1579	0.3891
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0061	0.00000000031965
Loa Loa (eye worm)	RecQ helicase	0.0021	0.046	0.0405
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1501	0.1453
Echinococcus multilocularis	calpain 7 (C02 family)	0.002	0.0429	0.1058
Echinococcus multilocularis	hypothetical protein	0.002	0.0429	0.1058
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0014	0.0234	0.0434
Schistosoma mansoni	calpain-7 (C02 family)	0.002	0.0429	0.0922
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.002	0.0429	0.1058
Trypanosoma brucei	calpain-like protein, putative	0.002	0.0429	0.1058
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0131	0.4058	1
Entamoeba histolytica	dipeptidyl-peptidase, putative	0.0014	0.0229	0.9771
Schistosoma mansoni	acylaminoacyl-peptidase (S09 family)	0.0014	0.0229	0.0421
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Schistosoma mansoni	dipeptidyl-peptidase 9 (S09 family)	0.0014	0.0229	0.0421
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0009	0.0061	0.015
Brugia malayi	prolyl oligopeptidase family protein	0.0014	0.0229	0.043
Trypanosoma cruzi	kinesin, putative	0.0014	0.0234	0.0577
Mycobacterium ulcerans	protease II (oligopeptidase B), PtrB	0.0052	0.1481	0.2839
Brugia malayi	prolyl oligopeptidase family protein	0.0014	0.0229	0.043
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.1058
Echinococcus granulosus	calpain	0.002	0.0429	0.1058
Trypanosoma brucei	serine peptidase, Clan SC, Family S9B	0.0014	0.0229	0.0564
Echinococcus multilocularis	calpain family protein 1, d	0.0039	0.1047	0.2581
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.0731
Trypanosoma brucei	Alpha/beta hydrolase domain-containing protein	0.0014	0.0229	0.0564
Brugia malayi	prolyl oligopeptidase family protein	0.0014	0.0229	0.043
Leishmania major	calpain, putative,cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.0731
Trypanosoma cruzi	oligopeptidase b	0.0052	0.1481	0.3651
Brugia malayi	prolyl oligopeptidase family protein	0.0014	0.0229	0.043
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Mycobacterium tuberculosis	Probable peptidase	0.0052	0.1481	0.2839
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.002	0.0429	0.1058
Trichomonas vaginalis	mucin-desulfating sulfatase, putative	0.0008	0.0057	0.1233
Loa Loa (eye worm)	calpain	0.002	0.0429	0.0375
Loa Loa (eye worm)	calpain family protein 1	0.0039	0.1047	0.0996
Loa Loa (eye worm)	hypothetical protein	0.0131	0.4058	0.4024
Leishmania major	oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein	0.0052	0.1481	0.3418
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0018	0.0374	0.8138
Brugia malayi	calpain family protein 1	0.0053	0.1501	0.361
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Trypanosoma cruzi	serine peptidase, clan SC, family S9A-like protein, putative	0.0052	0.1481	0.3651
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0852	0.08
Leishmania major	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	0.0131	0.4058	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0229	0.0173
Echinococcus granulosus	calpain 5	0.002	0.0429	0.1058
Loa Loa (eye worm)	prolyl oligopeptidase	0.0014	0.0229	0.0173
Echinococcus multilocularis	prolyl endopeptidase	0.0131	0.4058	1
Trypanosoma brucei	kinesin, putative	0.0014	0.0234	0.0577
Toxoplasma gondii	hypothetical protein	0.0014	0.0229	0.0421
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.0055	0.1579	0.3891
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Brugia malayi	prolyl oligopeptidase family protein	0.0131	0.4058	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Echinococcus multilocularis	calpain 5	0.002	0.0429	0.1058
Echinococcus granulosus	prolyl endopeptidase	0.0131	0.4058	1
Mycobacterium ulcerans	epoxide hydrolase EphA	0.0162	0.5074	1
Echinococcus granulosus	dipeptidyl aminopeptidaseprotein	0.0014	0.0229	0.0564
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0061	0.001
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trypanosoma brucei	Dipeptidyl-peptidase 8-like, putative	0.0014	0.0229	0.0564
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Toxoplasma gondii	acylaminoacyl-peptidase, putative	0.0014	0.0229	0.0421
Brugia malayi	calpain family protein 1	0.0053	0.1501	0.361
Trichomonas vaginalis	DNA helicase recq1, putative	0.0021	0.046	1
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Echinococcus multilocularis	acylamino acid releasing enzyme	0.0014	0.0229	0.0564
Trypanosoma cruzi	prolyl endopeptidase	0.0131	0.4058	1
Trypanosoma brucei	prolyl oligopeptidase, putative	0.0052	0.1481	0.3651
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0014	0.0229	0.9771
Echinococcus multilocularis	calpain A	0.0055	0.1579	0.3891
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0057	0.1233
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0018	0.0377	1
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0061	0.0004
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0055	0.1579	0.3799
Echinococcus granulosus	bloom syndrome protein	0.0021	0.046	0.1133
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.002	0.0429	0.1058
Giardia lamblia	Alanyl dipeptidyl peptidase	0.0014	0.0229	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	0	Inhibition of calpain I in C2C12 myoblasts loaded with Suc-Leu-Tyr-AMC	ChEMBL.	16185867
IC50 (binding)	> 1 uM	Inhibitory activity against porcine calpain I using Suc-Leu-Tyr-AMC fluorogenic substrate	ChEMBL.	16185867
IC50 (binding)	> 1 uM	Inhibitory activity against porcine calpain I using Suc-Leu-Tyr-AMC fluorogenic substrate	ChEMBL.	16185867

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: CHEMBL198539

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 345616