TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 458.554 | Formula: C30H26N4O
H donors: 3 H acceptors: 2 LogP: 6.09 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1cccc(c1)c1cccc(c1)c1nc2c([nH]1)c(C)ccc2)NC1CC1c1ccccc1
InChi: 1S/C30H26N4O/c1-19-8-5-15-26-28(19)34-29(32-26)23-13-6-11-21(16-23)22-12-7-14-24(17-22)31-30(35)33-27-18-25(27)20-9-3-2-4-10-20/h2-17,25,27H,18H2,1H3,(H,32,34)(H2,31,33,35)
InChiKey: MYQBZMNKLFIFNX-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.0115	0.1439	0.2377
Onchocerca volvulus		0.0024	0.0184	0.0304
Trypanosoma brucei	hypothetical protein, conserved	0.0115	0.1439	1
Loa Loa (eye worm)	pyruvate kinase	0.0034	0.032	0.0378
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.01	0.0983
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0081	0.0967	0.1145
Mycobacterium tuberculosis	Probable lipase LipD	0.0115	0.1439	0.1365
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0256	0.338	0.5583
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0043	0.0443	0.3065
Plasmodium falciparum	pyruvate kinase 2	0.0017	0.0091	0.0899
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0184	0.1261
Schistosoma mansoni	ferritin	0.0026	0.0206	0.0244
Onchocerca volvulus		0.0115	0.1439	0.2377
Loa Loa (eye worm)	MH2 domain-containing protein	0.0122	0.1529	0.1811
Brugia malayi	beta-lactamase family protein	0.0115	0.1439	0.2377
Trichomonas vaginalis	D-aminoacylase, putative	0.0115	0.1439	1
Echinococcus granulosus	tar DNA binding protein	0.0194	0.2533	0.2999
Brugia malayi	Probable ClpP-like protease	0.0082	0.0987	0.1631
Echinococcus granulosus	lamin	0.0027	0.0218	0.0258
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0082	0.0987	0.6854
Echinococcus granulosus	tumor protein p63	0.0341	0.4552	0.5391
Mycobacterium leprae	Probable lipase LipE	0.0115	0.1439	1
Schistosoma mansoni	ferritin	0.0026	0.0206	0.0244
Echinococcus multilocularis	lamin dm0	0.0027	0.0218	0.0258
Echinococcus granulosus	pyruvate kinase	0.0017	0.0091	0.0108
Trichomonas vaginalis	ferritin, putative	0.0026	0.0206	0.1417
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0027	0.0218	0.0258
Echinococcus multilocularis	transportin 1	0.0011	0.0003	0.0003
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0043	0.0443	0.0525
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.01	0.0014
Schistosoma mansoni	mucolipin	0.007	0.0815	0.0965
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0047	0.0503	0.1641
Mycobacterium tuberculosis	Conserved protein	0.0115	0.1439	0.1365
Plasmodium vivax	pyruvate kinase 2, putative	0.0017	0.0091	0.0616
Brugia malayi	RNA recognition motif domain containing protein	0.0194	0.2533	0.4184
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Echinococcus multilocularis	pyruvate kinase	0.0017	0.0091	0.0108
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0028	0.0033
Brugia malayi	Intermediate filament tail domain containing protein	0.0027	0.0218	0.036
Echinococcus granulosus	mucolipin 3	0.007	0.0815	0.0965
Toxoplasma gondii	pyruvate kinase PyKII	0.0017	0.0091	0.0616
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0184	0.0629
Schistosoma mansoni	hypothetical protein	0.0623	0.8445	1
Brugia malayi	cytoplasmic intermediate filament protein	0.0014	0.0047	0.0078
Echinococcus multilocularis	expressed protein	0.0026	0.0206	0.0244
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0082	0.0987	0.6854
Schistosoma mansoni	intermediate filament proteins	0.0027	0.0218	0.0258
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0248	0.3277	0.388
Echinococcus multilocularis	translational activator gcn1	0.0011	0.0003	0.0003
Mycobacterium ulcerans	pyruvate kinase	0.0034	0.032	0.1642
Echinococcus multilocularis	GPCR, family 2	0.0081	0.0967	0.1145
Brugia malayi	Pyruvate kinase, M2 isozyme	0.0034	0.032	0.0528
Schistosoma mansoni	ferritin	0.0026	0.0206	0.0244
Schistosoma mansoni	pyruvate kinase	0.0017	0.0091	0.0108
Trypanosoma brucei	importin beta-1 subunit, putative	0.0058	0.0656	0.4545
Schistosoma mansoni	pyruvate kinase	0.0034	0.032	0.0378
Echinococcus multilocularis	pyruvate kinase	0.0027	0.0221	0.0261
Onchocerca volvulus		0.005	0.0539	0.089
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0115	0.1439	0.1365
Brugia malayi	N-terminal motif family protein	0.0183	0.2379	0.3929
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0184	0.0629
Loa Loa (eye worm)	hypothetical protein	0.0018	0.01	0.0118
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0194	0.2533	0.2999
Loa Loa (eye worm)	hypothetical protein	0.0018	0.01	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0175	0.2263	0.268
Brugia malayi	Importin beta-1 subunit	0.0058	0.0656	0.1083
Trichomonas vaginalis	ran, putative	0.0043	0.0443	0.3065
Brugia malayi	Pyruvate kinase, muscle isozyme	0.0034	0.032	0.0528
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0021	0.0025
Echinococcus multilocularis	importin 5	0.0011	0.0003	0.0003
Loa Loa (eye worm)	intermediate filament protein	0.0027	0.0218	0.0258
Echinococcus granulosus	beta LACTamase domain containing family member	0.0115	0.1439	0.1704
Trichomonas vaginalis	pyruvate kinase, putative	0.0034	0.032	0.2205
Leishmania major	importin beta-1 subunit, putative	0.0047	0.0503	0.3485
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0043	0.0443	0.0525
Schistosoma mansoni	lamin	0.0027	0.0218	0.0258
Schistosoma mansoni	survival motor neuron protein	0.005	0.0543	0.0643
Brugia malayi	hypothetical protein	0.0246	0.3246	0.5362
Brugia malayi	kap beta 3 protein	0.0011	0.0003	0.0005
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0093	0.1134	0.1343
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0115	0.1439	0.1365
Toxoplasma gondii	HEAT repeat-containing protein	0.0058	0.0656	0.4545
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0184	0.0218
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Onchocerca volvulus	Pyruvate kinase homolog	0.0034	0.032	0.0528
Schistosoma mansoni	ferritin light chain	0.0026	0.0206	0.0244
Echinococcus multilocularis	survival motor neuron protein 1	0.0246	0.3246	0.3844
Trypanosoma cruzi	hypothetical protein, conserved	0.0115	0.1439	1
Brugia malayi	RNA binding protein	0.0194	0.2533	0.4184
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0043	0.0443	0.0732
Trypanosoma cruzi	hypothetical protein, conserved	0.0115	0.1439	1
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0043	0.0443	0.4472
Echinococcus granulosus	transportin 1	0.0011	0.0003	0.0003
Schistosoma mansoni	lozenge	0.0056	0.0629	0.0744
Plasmodium falciparum	pyruvate kinase	0.0034	0.032	0.3217
Brugia malayi	hypothetical protein	0.045	0.6054	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0115	0.1439	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0184	0.0218
Loa Loa (eye worm)	transcription factor SMAD2	0.0122	0.1529	0.1811
Mycobacterium leprae	PROBABLE BACTERIOFERRITIN BFRA	0.0026	0.0206	0.0179
Echinococcus granulosus	pyruvate kinase	0.0017	0.0091	0.0108
Echinococcus granulosus	lamin dm0	0.0027	0.0218	0.0258
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0115	0.1439	0.1704
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0184	0.0629
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.1134	0.1343
Schistosoma mansoni	hypothetical protein	0.005	0.0543	0.0643
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Schistosoma mansoni	ran	0.0043	0.0443	0.0525
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0093	0.1134	0.1343
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0043	0.0443	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0184	0.0218
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0093	0.1134	0.1343
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0184	0.0304
Brugia malayi	TAR-binding protein	0.0194	0.2533	0.4184
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0115	0.1439	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0184	0.1261
Mycobacterium tuberculosis	Conserved protein	0.0115	0.1439	0.1365
Loa Loa (eye worm)	runx1	0.0056	0.0629	0.0744
Mycobacterium tuberculosis	Probable esterase LipL	0.0115	0.1439	0.1365
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0184	0.0629
Schistosoma mansoni	hypothetical protein	0.0081	0.0967	0.1145
Schistosoma mansoni	lamin	0.0027	0.0218	0.0258
Echinococcus multilocularis	tumor protein p63	0.0341	0.4552	0.5391
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0184	0.3618
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0028	0.0242	0.1667
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0028	0.0033
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0656	0.0776
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0178	0.021
Schistosoma mansoni	peptidase Clp (S14 family)	0.0082	0.0987	0.1169
Mycobacterium ulcerans	esterase/lipase LipP	0.0115	0.1439	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0054	0.0596	0.0514
Mycobacterium ulcerans	bacterioferritin BfrA	0.0026	0.0206	0.0796
Mycobacterium tuberculosis	Bacterioferritin BfrB	0.0026	0.0206	0.0121
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0184	0.3618
Loa Loa (eye worm)	hypothetical protein	0.0018	0.01	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0034	0.032	0.0378
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0211	0.025
Echinococcus multilocularis	importin subunit beta 1	0.0058	0.0656	0.0776
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0184	0.0099
Loa Loa (eye worm)	hypothetical protein	0.045	0.6054	0.7168
Mycobacterium tuberculosis	Probable pyruvate kinase PykA	0.0034	0.032	0.0236
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0183	0.2379	0.3929
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0021	0.0025
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0081	0.0967	0.1145
Loa Loa (eye worm)	hypothetical protein	0.0018	0.01	0.0118
Brugia malayi	latrophilin 2 splice variant baaae	0.0175	0.2263	0.3738
Trichomonas vaginalis	esterase, putative	0.0115	0.1439	1
Echinococcus multilocularis	mucolipin 3	0.007	0.0815	0.0965
Schistosoma mansoni	tar DNA-binding protein	0.0194	0.2533	0.2999
Loa Loa (eye worm)	hypothetical protein	0.0256	0.338	0.4002
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0043	0.0443	0.1103
Loa Loa (eye worm)	beta-lactamase	0.0115	0.1439	0.1704
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0184	0.0304
Echinococcus multilocularis	pyruvate kinase	0.0017	0.0091	0.0108
Echinococcus granulosus	ferritin	0.0026	0.0206	0.0244
Loa Loa (eye worm)	pyruvate kinase-PB	0.0024	0.0178	0.021
Mycobacterium tuberculosis	Probable hydrolase	0.0115	0.1439	0.1365
Entamoeba histolytica	hypothetical protein	0.0047	0.0503	1
Onchocerca volvulus		0.0027	0.0218	0.036
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0115	0.1439	0.1704
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0082	0.0987	0.1169
Onchocerca volvulus		0.0027	0.0218	0.036
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0115	0.1439	0.2377
Onchocerca volvulus		0.045	0.6054	1
Trichomonas vaginalis	pyruvate kinase, putative	0.0034	0.032	0.2205
Loa Loa (eye worm)	TAR-binding protein	0.0194	0.2533	0.2999
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0082	0.0987	0.6854
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	0.6627
Echinococcus granulosus	intermediate filament protein	0.0027	0.0218	0.0258
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0184	0.0629
Echinococcus granulosus	translational activator gcn1	0.0011	0.0003	0.0003
Echinococcus multilocularis	Protein lozenge	0.0056	0.0629	0.0744
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Onchocerca volvulus		0.005	0.0543	0.0897
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0256	0.338	0.4002
Echinococcus granulosus	pyruvate kinase	0.0034	0.032	0.0378
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0115	0.1439	0.1704
Leishmania major	GTP-binding protein, putative	0.0043	0.0443	0.3065
Schistosoma mansoni	apoferritin-2	0.0026	0.0206	0.0244
Chlamydia trachomatis	pyruvate kinase	0.0034	0.032	0.2478
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0028	0.0242	0.2432
Echinococcus multilocularis	geminin	0.0343	0.4588	0.5433
Schistosoma mansoni	importin-beta 2	0.0011	0.0003	0.0003
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0081	0.0967	0.1145
Loa Loa (eye worm)	pyruvate kinase	0.0034	0.032	0.0378
Loa Loa (eye worm)	hypothetical protein	0.005	0.0539	0.0638
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	0.6627
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0184	0.0629
Brugia malayi	MH2 domain containing protein	0.0122	0.1529	0.2526
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0115	0.1439	0.1365
Brugia malayi	intermediate filament protein	0.0027	0.0218	0.036
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0047	0.0056
Echinococcus multilocularis	lamin	0.0027	0.0218	0.0258
Toxoplasma gondii	pyruvate kinase PyK1	0.0034	0.032	0.2205
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	1
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0047	0.0503	0.3485
Loa Loa (eye worm)	hypothetical protein	0.045	0.6054	0.7168
Schistosoma mansoni	ran	0.0043	0.0443	0.0525
Mycobacterium tuberculosis	Probable bacterioferritin BfrA	0.0026	0.0206	0.0121
Onchocerca volvulus	Pyruvate kinase homolog	0.0034	0.032	0.0528
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.01	0.0674
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0054	0.0596	0.328
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.1134	0.1343
Loa Loa (eye worm)	RNA binding protein	0.0194	0.2533	0.2999
Echinococcus granulosus	expressed protein	0.0026	0.0206	0.0244
Entamoeba histolytica	pyruvate kinase, putative	0.0024	0.0178	0.3493
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0043	0.0443	0.1103
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0054	0.0596	0.0705
Echinococcus granulosus	importin 5	0.0011	0.0003	0.0003
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0623	0.8445	1
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0082	0.0987	0.1169
Leishmania major	pyruvate kinase	0.0034	0.032	0.2205
Trichomonas vaginalis	D-aminoacylase, putative	0.0115	0.1439	1
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0967	0.1145
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0043	0.0443	0.3065
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0093	0.1134	0.1343
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0987	0.1169
Echinococcus granulosus	pyruvate kinase	0.0017	0.0091	0.0108
Plasmodium vivax	hypothetical protein, conserved	0.0115	0.1439	1
Schistosoma mansoni	hypothetical protein	0.0081	0.0967	0.1145
Mycobacterium tuberculosis	Conserved protein	0.0115	0.1439	0.1365
Leishmania major	hypothetical protein, conserved	0.0115	0.1439	1
Schistosoma mansoni	hypothetical protein	0.0343	0.4588	0.5433
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0256	0.338	0.5583
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0184	0.0099
Schistosoma mansoni	tar DNA-binding protein	0.0194	0.2533	0.2999
Echinococcus multilocularis	pyruvate kinase	0.0034	0.032	0.0378
Schistosoma mansoni	hypothetical protein	0.0343	0.4588	0.5433
Trypanosoma brucei	pyruvate kinase 1	0.0034	0.032	0.2205
Mycobacterium leprae	Probable pyruvate kinase PykA	0.0034	0.032	0.1081
Echinococcus granulosus	pyruvate kinase	0.0034	0.032	0.0378
Schistosoma mansoni	importin beta-1	0.0058	0.0656	0.0776
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0093	0.1134	0.1874
Loa Loa (eye worm)	mucolipin 1	0.007	0.0815	0.0965
Loa Loa (eye worm)	pyruvate kinase	0.0034	0.032	0.0378
Giardia lamblia	Pyruvate kinase	0.0034	0.032	0.649
Echinococcus granulosus	importin subunit beta 1	0.0058	0.0656	0.0776
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0218	0.0258
Loa Loa (eye worm)	hypothetical protein	0.0246	0.3246	0.3844
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0184	0.3618
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0043	0.0443	0.0525
Echinococcus granulosus	snurportin 1	0.0623	0.8445	1
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	1
Mycobacterium ulcerans	hypothetical protein	0.0115	0.1439	1
Echinococcus multilocularis	pyruvate kinase	0.0017	0.0091	0.0108
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0081	0.0967	0.1598
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0028	0.0033
Schistosoma mansoni	tar DNA-binding protein	0.0194	0.2533	0.2999
Echinococcus granulosus	peptidase Clp S14 family	0.0054	0.0596	0.0705
Echinococcus multilocularis	musashi	0.0027	0.0218	0.0258
Onchocerca volvulus	Pyruvate kinase homolog	0.0034	0.032	0.0528
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0043	0.0443	0.3065
Toxoplasma gondii	ABC1 family protein	0.0115	0.1439	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0054	0.0596	0.0514
Echinococcus multilocularis	snurportin 1	0.0623	0.8445	1
Leishmania major	pyruvate kinase	0.0034	0.032	0.2205
Trichomonas vaginalis	penicillin-binding protein, putative	0.0115	0.1439	1
Schistosoma mansoni	cellular tumor antigen P53	0.005	0.0539	0.0638
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0184	0.0629
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1439	0.1704
Loa Loa (eye worm)	importin-beta domain-containing protein	0.0011	0.0003	0.0003
Brugia malayi	beta-lactamase family protein	0.0115	0.1439	0.2377
Plasmodium falciparum	importin beta, putative	0.0058	0.0656	0.6631
Schistosoma mansoni	tar DNA-binding protein	0.0194	0.2533	0.2999
Plasmodium vivax	importin-beta 2, putative	0.0058	0.0656	0.4545
Echinococcus granulosus	geminin	0.0343	0.4588	0.5433
Plasmodium vivax	pyruvate kinase, putative	0.0034	0.032	0.2205
Schistosoma mansoni	hypothetical protein	0.0081	0.0967	0.1145
Loa Loa (eye worm)	kap beta 3 protein	0.0011	0.0003	0.0003
Mycobacterium leprae	conserved hypothetical protein	0.0115	0.1439	1
Echinococcus granulosus	survival motor neuron protein 1	0.0246	0.3246	0.3844
Brugia malayi	Latrophilin receptor protein 2	0.0081	0.0967	0.1598
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0093	0.1134	0.1343
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0115	0.1439	0.1704
Schistosoma mansoni	hypothetical protein	0.0175	0.2263	0.268
Mycobacterium tuberculosis	Probable lipase LipE	0.0115	0.1439	0.1365
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0081	0.0967	0.1145
Schistosoma mansoni	ferritin light chain	0.0026	0.0206	0.0244
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0184	0.0304
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0184	0.1261
Echinococcus multilocularis	pyruvate kinase	0.0034	0.032	0.0378
Schistosoma mansoni	mucolipin	0.0064	0.0735	0.087
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0184	0.0629
Loa Loa (eye worm)	hypothetical protein	0.0018	0.01	0.0118
Brugia malayi	beta-lactamase	0.0115	0.1439	0.2377
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0028	0.0242	0.046
Mycobacterium leprae	ATP-dependent Clp protease proteolytic subunit 1	0.0028	0.0242	0.0464
Trypanosoma brucei	pyruvate kinase 1, putative	0.0034	0.032	0.2205
Toxoplasma gondii	hypothetical protein	0.0028	0.0242	0.1667
Mycobacterium ulcerans	beta-lactamase	0.0115	0.1439	1
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0047	0.0503	0.3485
Schistosoma mansoni	apoferritin-2	0.0026	0.0206	0.0244
Brugia malayi	RNA, U transporter 1	0.0166	0.214	0.3535
Entamoeba histolytica	Ran family GTPase	0.0043	0.0443	0.8795
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	1
Schistosoma mansoni	hypothetical protein	0.0081	0.0967	0.1145
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0082	0.0987	0.64
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.005	0.0543	0.0897
Mycobacterium ulcerans	bacterioferritin BfrB	0.0026	0.0206	0.0796
Trypanosoma brucei	importin beta-1 subunit, putative	0.0058	0.0656	0.4545
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0082	0.0987	1
Schistosoma mansoni	pyruvate kinase	0.0034	0.032	0.0378
Onchocerca volvulus		0.0115	0.1439	0.2377
Brugia malayi	Coelomocyte uptake defective protein 5	0.007	0.0815	0.1347
Brugia malayi	follicle stimulating hormone receptor	0.0248	0.3277	0.5413
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.1134	0.1343
Schistosoma mansoni	ferritin	0.0026	0.0206	0.0244
Echinococcus multilocularis	ferritin	0.0026	0.0206	0.0244
Echinococcus multilocularis	tar DNA binding protein	0.0194	0.2533	0.2999
Mycobacterium ulcerans	lipase LipD	0.0115	0.1439	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0081	0.0967	0.1145
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2379	0.2817
Trichomonas vaginalis	D-aminoacylase, putative	0.0115	0.1439	1
Trichomonas vaginalis	importin beta-1, putative	0.0047	0.0503	0.3485
Echinococcus granulosus	GPCR family 2	0.0081	0.0967	0.1145
Schistosoma mansoni	tar DNA-binding protein	0.0194	0.2533	0.2999

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 0 %	GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM.	ChEMBL.	20485427
Inhibition (functional)	= 0 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 1.8 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 2.2 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 5.21 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 28 %	GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 98 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition frequency index (IFI) (functional)	= 2.06	Inhibition Frequency Index (IFI)	GSK.	20485427
Percent growth inhibition (functional)	= -4 %	Percent inhibition of HepG2 growth (at 10 uM)	GSK.	20485427
Percent growth inhibition (functional)	= -1 %	Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 28 %	Percent inhibition of P. falciparum Dd2 growth (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 98 %	Percent inhibition of P. falciparum 3D7 growth (at 2 uM)	GSK.	20485427
XC50 (functional)	= 6.15	XC50 determination of P. falciparum 3D7 growth	GSK.	20485427
XC50 (functional)	= 0.70531 uM	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth.	ChEMBL.	20485427

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: CHEMBL531698
Search by GSK

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 597952