TDR Targets

Basic information

Technical information

TDR Targets ID: 1435651
Name: T5298385
MW: 435.924 | Formula: C20H22ClN3O4S
H donors: 2 H acceptors: 4 LogP: 2.27 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1cccc(c1)S(=O)(=O)N1CCCC1)CCNC(=O)c1ccccc1Cl
InChi: 1S/C20H22ClN3O4S/c21-18-9-2-1-8-17(18)20(26)22-11-10-19(25)23-15-6-5-7-16(14-15)29(27,28)24-12-3-4-13-24/h1-2,5-9,14H,3-4,10-13H2,(H,22,26)(H,23,25)
InChiKey: DQRKUIHLZCUWTO-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	bromodomain adjacent to zinc finger domain, 2B	Starlite/ChEMBL	No references
Escherichia coli	penicillin-binding protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	Get druggable targets OG5_131570	All targets in OG5_131570
Mycobacterium tuberculosis	Possible penicillin-binding protein	Get druggable targets OG5_149948	All targets in OG5_149948
Schistosoma mansoni	bromodomain containing protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	Conserved hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	Cleft lip and palate transmembrane protein 1-like protein, putative	Get druggable targets OG5_131570	All targets in OG5_131570
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	ko:K01549 ATP synthase [EC3.6.3.14], putative	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	expressed protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Brugia malayi	Bromodomain containing protein	Get druggable targets OG5_131570	All targets in OG5_131570

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
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0214	0.3202	1
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0778	0.1333
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.0002	0.5
Echinococcus multilocularis	Zinc finger, PHD finger	0.0058	0.0275	0.0275
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0103	0.1117	0.2707
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0164	0.2274	0.5513
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0236	0.3625	0.879
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0058	0.0275	0.0664
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0188	0.2711	0.7273
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0576	1	1
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0157	0.2133	0.2133
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Trichomonas vaginalis	PIKK family atypical protein kinase	0.02	0.2952	0.7157
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0224	0.3398	0.8241
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2867	0.6951
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Trichomonas vaginalis	conserved hypothetical protein	0.0075	0.0597	0.1444
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0236	0.3625	0.879
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0157	0.2133	0.2133
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0075	0.0597	0.0597
Brugia malayi	Cytochrome P450 family protein	0.0054	0.0199	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0778	0.1333
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0097	0.1009	0.219
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0576	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0178	0.253	0.6133
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0058	0.0275	0.0275
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0103	0.1117	0.1116
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0224	0.3398	0.3397
Loa Loa (eye worm)	hypothetical protein	0.0114	0.1326	0.2273
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0058	0.0275	0.0274
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0236	0.3625	0.3624
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0103	0.1117	0.1117
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0218	0.3288	0.7972
Mycobacterium leprae	Probable lipase LipE	0.0043	0.0002	0.5
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0075	0.0597	0.0597
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0097	0.1009	0.2443
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0103	0.1117	0.2707
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0218	0.3289	0.7975
Entamoeba histolytica	hypothetical protein	0.0103	0.1117	0.2514
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0218	0.3288	0.7972
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0139	0.179	0.434
Loa Loa (eye worm)	phosphatidylinositol 3	0.0236	0.3625	0.6219
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0236	0.3625	0.879
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0097	0.1009	0.1007
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0058	0.0275	0.0664
Onchocerca volvulus		0.0043	0.0002	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0154	0.2084	0.5052
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0236	0.3625	0.3625
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0103	0.1117	0.1117
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0139	0.179	0.434
Brugia malayi	FAT domain containing protein	0.0075	0.0597	0.0595
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0157	0.2133	0.2132
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2867	0.6951
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0218	0.3289	0.7975
Schistosoma mansoni	hypothetical protein	0.0075	0.0597	0.0595
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0236	0.3625	1
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0058	0.0275	0.0274
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0118	0.14	0.3357
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0164	0.2274	0.5513
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0178	0.253	0.6133
Loa Loa (eye worm)	phosphatidylinositol 3	0.0058	0.0279	0.0477
Mycobacterium ulcerans	hypothetical protein	0.0043	0.0002	0.5
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0075	0.0587	0.142
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0576	1	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0152	0.0259
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0058	0.0275	0.0664
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0218	0.3288	0.7972
Echinococcus granulosus	serine protein kinase ATM	0.0103	0.1117	0.1117
Giardia lamblia	GTOR	0.0236	0.3625	1
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0058	0.0275	0.0275
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0236	0.3625	0.879
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0058	0.0275	0.0275
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0097	0.1009	0.219
Onchocerca volvulus		0.0043	0.0002	0.5
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0097	0.1009	0.1007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0388	0.0937
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2867	0.6951
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0392	0.6561	0.6561
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0064	0.0388	0.0386
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0058	0.0275	0.0274
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0058	0.0275	0.0855
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0236	0.3625	0.3624
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0072	0.0539	0.0539
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0576	1	1
Loa Loa (eye worm)	hypothetical protein	0.0075	0.0597	0.1021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.02	0.2952	0.7157
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0178	0.253	0.6133
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0392	0.6561	0.6561
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0103	0.1117	0.1116
Entamoeba histolytica	protein kinase rad3, putative	0.0103	0.1117	0.2514
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0178	0.253	0.6133
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0224	0.3398	0.3397
Brugia malayi	Bromodomain containing protein	0.0046	0.0054	0.0052
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0058	0.0275	0.0855
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0097	0.1009	0.2443
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2865	0.6948
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0218	0.3288	0.7972
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0058	0.0279	0.0278
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0185	0.2665	0.7134
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0002	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0103	0.1117	0.1915
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0388	0.0663
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0109	0.0184
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0263	0.4123	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2867	0.6951
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0058	0.0275	0.047
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0072	0.0539	0.0539
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0058	0.0275	1
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0576	1	1
Mycobacterium ulcerans	beta-lactamase	0.0043	0.0002	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0097	0.1009	0.2443
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0103	0.1117	0.1116
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0058	0.0275	0.0664
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0178	0.253	0.6133
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2865	0.6948
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0055	0.0092
Mycobacterium leprae	conserved hypothetical protein	0.0043	0.0002	0.5
Trypanosoma cruzi	target of rapamycin kinase 3	0.0218	0.3289	0.3288
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0392	0.6561	0.656
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0218	0.3288	0.7972
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0236	0.3625	0.3625
Toxoplasma gondii	FATC domain-containing protein	0.0103	0.1117	0.3486
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0188	0.2711	0.6574
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0196	0.2865	0.6948
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0143	0.1875	0.4546
Loa Loa (eye worm)	hypothetical protein	0.0157	0.2133	0.3659
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0132	0.1663	0.4031
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0236	0.3625	0.879
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0058	0.0275	0.0274
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0058	0.0275	0.0274
Echinococcus multilocularis	serine protein kinase ATM	0.0103	0.1117	0.1117
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0161	0.2213	0.5364
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0103	0.1117	0.1116
Loa Loa (eye worm)	hypothetical protein	0.0085	0.079	0.1352
Brugia malayi	Bromodomain containing protein	0.0091	0.0887	0.0885
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0236	0.3625	1
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0114	0.1326	0.4138
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0139	0.179	0.434
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0224	0.3398	0.3397
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0224	0.3398	0.8241
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0236	0.3625	0.879
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0097	0.1009	0.1007
Schistosoma mansoni	bromodomain containing protein	0.0076	0.0621	0.0619
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0058	0.0275	0.0664
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.0002	0.5
Loa Loa (eye worm)	phosphatidylinositol 3	0.0263	0.4123	0.7075
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0278	0.4405	1
Trichomonas vaginalis	conserved hypothetical protein	0.0114	0.1326	0.3213
Loa Loa (eye worm)	phosphatidylinositol 3	0.0353	0.5827	1
Entamoeba histolytica	hypothetical protein	0.0185	0.2665	0.7134
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0178	0.253	0.6133
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0103	0.1117	0.2707
Onchocerca volvulus		0.0043	0.0002	0.5
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0185	0.2669	0.7146
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0236	0.3625	0.3624
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0263	0.4123	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0103	0.1117	0.1116
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0168	0.2347	0.2346
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0103	0.1117	0.1116
Mycobacterium ulcerans	lipase LipD	0.0043	0.0002	0.5
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0097	0.1009	0.2443
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0058	0.0275	0.5
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0058	0.0275	0.0664
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Loa Loa (eye worm)	hypothetical protein	0.0067	0.045	0.0769
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0057	0.025	0.0602
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0125	0.154	0.3
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0236	0.3625	0.3624
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0002	0.0002
Trichomonas vaginalis	conserved hypothetical protein	0.0064	0.0388	0.0937
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0263	0.4123	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0214	0.3202	0.7766
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0224	0.3398	0.8241
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0224	0.3398	0.9324
Loa Loa (eye worm)	cytochrome P450 family protein	0.0054	0.0199	0.0338
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0236	0.3625	0.879

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.7079 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (functional)	= 5.0119 um	PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))]	ChEMBL.	No reference
Potency (functional)	10.4179 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	11.6891 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	25.929 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1604676

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1435651