TDR Targets

Basic information

Technical information

TDR Targets ID: 145255
Name: 4,5-dibromo-N-[3-[4-[3-[(7-chloroquinolin-4-y l)amino]propyl]piperazin-1-yl]propyl]thiophen e-2-sulfonamide
MW: 665.892 | Formula: C23H28Br2ClN5O2S2
H donors: 2 H acceptors: 3 LogP: 5.76 Rotable bonds: 11
Rule of 5 violations (Lipinski): 2
SMILES: Clc1ccc2c(c1)nccc2NCCCN1CCN(CC1)CCCNS(=O)(=O)c1sc(c(c1)Br)Br
InChi: 1S/C23H28Br2ClN5O2S2/c24-19-16-22(34-23(19)25)35(32,33)29-7-2-10-31-13-11-30(12-14-31)9-1-6-27-20-5-8-28-21-15-17(26)3-4-18(20)21/h3-5,8,15-16,29H,1-2,6-7,9-14H2,(H,27,28)
InChiKey: OIUFCVLTTOUMIZ-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

4,5-dibromo-N-[3-[4-[3-[(7-chloro-4-quinolyl)amino]propyl]piperazin-1-yl]propyl]thiophene-2-sulfonamide
4,5-dibromo-N-[3-[4-[3-[(7-chloro-4-quinolyl)amino]propyl]-1-piperazinyl]propyl]-2-thiophenesulfonamide
4,5-dibromo-N-[3-[4-[3-[(7-chloro-4-quinolyl)amino]propyl]piperazino]propyl]thiophene-2-sulfonamide

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
Schistosoma mansoni	hypothetical protein	0.0298	0.0408	0.8486
Mycobacterium tuberculosis	Probable lipase LipE	0.0074	0.0089	0.0081
Schistosoma mansoni	metabotropic glutamate receptor	0.0021	0.0014	0.0182
Onchocerca volvulus		0.0074	0.0089	1
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.005	0.0055	0.1036
Echinococcus multilocularis	Niemann Pick C1 protein	0.0153	0.0202	0.0834
Loa Loa (eye worm)	cytochrome P450 family protein	0.0054	0.0061	0.1494
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0024	0.0582
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0035	0.0124
Schistosoma mansoni	hypothetical protein	0.0047	0.005	0.0943
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0016	0.0967
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0016	0.0967
Echinococcus granulosus	survival motor neuron protein 1	0.0229	0.0309	0.6413
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.00539428	0.00463321	1
Echinococcus multilocularis	protein dispatched 1	0.0053	0.0059	0.0225
Echinococcus granulosus	importin subunit beta 1	0.0028	0.0024	0.038
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0089	1
Leishmania major	hypothetical protein, conserved	0.0074	0.0089	1
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0021	0.0013	0.06
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0031	0.0759
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0094	0.0118	0.2365
Mycobacterium tuberculosis	Transcriptional regulatory repressor protein (TetR-family) EthR	0.7054	1	1
Schistosoma mansoni	hypothetical protein	0.0044	0.0047	0.0872
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0094	0.0118	0.2365
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0053	0.1292
Echinococcus multilocularis	Niemann Pick C1 protein	0.0107	0.0136	0.0556
Echinococcus granulosus	mitogen activated protein kinase	0.005	0.0055	0.1046
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0053	0.1701
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.1669	0.2354	1
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0024	0.1895
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.0055	0.5531
Brugia malayi	Importin beta-1 subunit	0.0028	0.0024	0.0767
Trypanosoma brucei	protein kinase, putative	0.005	0.0055	0.58
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Mycobacterium tuberculosis	Transcriptional regulatory repressor protein (TetR-family) EthR	0.705438	1	0.5
Echinococcus multilocularis	metabotropic glutamate receptor 2	0.0037	0.0036	0.013
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0021	0.0013	0.0325
Echinococcus granulosus	beta LACTamase domain containing family member	0.0074	0.0089	0.1764
Schistosoma mansoni	ran	0.0021	0.0013	0.0158
Mycobacterium ulcerans	TetR family transcriptional regulator	0.705438	1	0.5
Brugia malayi	metabotropic glutamate receptor type 2	0.0021	0.0014	0.0465
Mycobacterium ulcerans	TetR family transcriptional regulator	0.7054	1	1
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0021	0.0013	0.0158
Mycobacterium ulcerans	hypothetical protein	0.0074	0.0089	0.0081
Echinococcus multilocularis	mitogen activated protein kinase 3	0.005	0.0055	0.0211
Echinococcus granulosus	Niemann Pick C1 protein	0.0153	0.0202	0.4137
Brugia malayi	Cytochrome P450 family protein	0.0054	0.0061	0.1968
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.0055	0.5531
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0094	0.0118	0.3805
Trypanosoma cruzi	cytochrome P450, putative	0.0026	0.002	0.1491
Schistosoma mansoni	hypothetical protein	0.0044	0.0047	0.0872
Loa Loa (eye worm)	cytochrome P450	0.0017	0.0008	0.0206
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.005	0.0055	0.58
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0053	0.1701
Echinococcus granulosus	sterol regulatory element binding protein	0.0046	0.0049	0.0922
Mycobacterium tuberculosis	Probable esterase LipL	0.0074	0.0089	0.0081
Mycobacterium leprae	Probable lipase LipE	0.0074	0.0089	0.0081
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0074	0.0089	0.1764
Mycobacterium ulcerans	AcrR family transcriptional regulator	0.7054	1	1
Echinococcus granulosus	snurportin 1	0.0298	0.0408	0.8486
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0074	0.0089	0.0356
Brugia malayi	Metabotropic glutamate receptor precursor.	0.0044	0.0046	0.1495
Onchocerca volvulus		0.0074	0.0089	1
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0049	0.1212
Loa Loa (eye worm)	hypothetical protein	0.0107	0.0136	0.3345
Loa Loa (eye worm)	inositol-1	0.0036	0.0035	0.0856
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0074	0.0089	0.0081
Trichomonas vaginalis	penicillin-binding protein, putative	0.0074	0.0089	1
Loa Loa (eye worm)	CYP4Cod1	0.0026	0.002	0.0502
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0035	0.3273
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0032	0.003	0.0021
Brugia malayi	cytochrome P450	0.0017	0.0008	0.0271
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0094	0.0118	0.0477
Echinococcus multilocularis	protein patched	0.0046	0.0049	0.0186
Schistosoma mansoni	ran	0.0021	0.0013	0.0158
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0015	0.0006	0.0141
Schistosoma mansoni	importin beta-1	0.0028	0.0024	0.038
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.005	0.0055	0.1357
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0089	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0031	0.0532
Brugia malayi	Cytochrome P450 family protein	0.0026	0.002	0.0661
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0021	0.0013	0.06
Schistosoma mansoni	metabotropic glutamate receptor	0.0037	0.0036	0.0642
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0016	0.0391
Mycobacterium leprae	conserved hypothetical protein	0.0074	0.0089	0.0081
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0053	0.1292
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0094	0.0118	0.2365
Loa Loa (eye worm)	hypothetical protein	0.0229	0.0309	0.7591
Echinococcus granulosus	metabotropic glutamate receptor 5	0.00539428	0.00463321	1
Echinococcus multilocularis	sterol regulatory element binding protein	0.0046	0.0049	0.0186
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0035	0.0026
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0074	0.0089	0.219
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0035	0.3273
Brugia malayi	Latrophilin receptor protein 2	0.0015	0.0006	0.0186
Brugia malayi	Metabotropic glutamate receptor precursor.	0.00438174	0.00319351	1
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0298	0.0408	1
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0035	0.5
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0016	0.0391
Giardia lamblia	Kinase, CMGC MAPK	0.005	0.0055	1
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0109	0.0139	0.2807
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0094	0.0118	0.2365
Schistosoma mansoni	patched 1	0.0046	0.0049	0.0922
Echinococcus granulosus	Niemann Pick C1 protein	0.0107	0.0136	0.2757
Trichomonas vaginalis	penicillin-binding protein, putative	0.0074	0.0089	1
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Entamoeba histolytica	hypothetical protein	0.0023	0.0016	0.0241
Plasmodium vivax	importin-beta 2, putative	0.0028	0.0024	0.1378
Schistosoma mansoni	survival motor neuron protein	0.0047	0.005	0.0943
Mycobacterium ulcerans	esterase/lipase LipP	0.0074	0.0089	0.0081
Loa Loa (eye worm)	glutamate receptor	0.0044	0.0046	0.1135
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0035	0.3273
Brugia malayi	hypothetical protein	0.0229	0.0309	1
Schistosoma mansoni	hypothetical protein	0.0044	0.0047	0.0872
Brugia malayi	hypothetical protein	0.0074	0.0089	0.2883
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0089	1
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0021	0.0013	0.0428
Echinococcus multilocularis	snurportin 1	0.0298	0.0408	0.1711
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0031	0.1
Loa Loa (eye worm)	hypothetical protein	0.00539428	0.00463321	1
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.0055	0.5531
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	0.00396974	0.0026077	0.816563
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0032	0.003	0.0021
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0089	0.0081
Mycobacterium tuberculosis	Probable hydrolase	0.0074	0.0089	0.0081
Echinococcus multilocularis	importin subunit beta 1	0.0028	0.0024	0.0077
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0047	0.005	0.1629
Echinococcus granulosus	geminin	0.0349	0.0479	1
Mycobacterium ulcerans	beta-lactamase	0.0074	0.0089	0.0081
Echinococcus granulosus	metabotropic glutamate receptor 5	0.0054	0.0061	0.1159
Echinococcus multilocularis		0.0017	0.0008	0.0011
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0015	0.0006	0.0186
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.005	0.0055	0.58
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.00498228	0.0040474	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0061	0.1488
Echinococcus multilocularis	mitogen activated protein kinase	0.005	0.0055	0.0211
Echinococcus granulosus	mitogen activated protein kinase 3	0.005	0.0055	0.1046
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0074	0.0089	0.0081
Trypanosoma brucei	hypothetical protein, conserved	0.0074	0.0089	1
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.0035	0.1757
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0035	0.0615
Plasmodium falciparum	importin beta, putative	0.0028	0.0024	1
Echinococcus granulosus	metabotropic glutamate receptor 2	0.0037	0.0036	0.0642
Trypanosoma brucei	cytochrome P450, putative	0.0026	0.002	0.1491
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.0054	0.0061	0.0234
Brugia malayi	MAP kinase sur-1	0.005	0.0055	0.1787
Schistosoma mansoni	hypothetical protein	0.0349	0.0479	1
Schistosoma mansoni	hypothetical protein	0.0074	0.0089	0.1762
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0094	0.0118	0.2365
Entamoeba histolytica	hypothetical protein	0.0074	0.0089	0.6171
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Entamoeba histolytica	hypothetical protein	0.0074	0.0089	0.6171
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0024	0.1895
Loa Loa (eye worm)	glutamate receptor	0.0017	0.0009	0.0209
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.005	0.0055	0.58
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0026	0.002	0.0012
Entamoeba histolytica	hypothetical protein	0.0074	0.0089	0.6171
Loa Loa (eye worm)	hypothetical protein	0.0056	0.0064	0.1573
Entamoeba histolytica	hypothetical protein	0.0074	0.0089	0.6171
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0094	0.0118	0.0477
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.005	0.0055	0.58
Echinococcus multilocularis	survival motor neuron protein 1	0.0229	0.0309	0.1293
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0074	0.0089	0.0081
Mycobacterium ulcerans	transcriptional regulator	0.705438	1	0.5
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0074	0.0089	0.1762
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0006	0.0141
Brugia malayi	RNA, U transporter 1	0.0079	0.0097	0.3131
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0089	0.0081
Mycobacterium ulcerans	transcriptional regulator	0.7054	1	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0074	0.0089	1
Trypanosoma cruzi	cytochrome P450, putative	0.0026	0.002	0.1491
Brugia malayi	beta-lactamase family protein	0.0074	0.0089	0.2885
Brugia malayi	Cytochrome P450 family protein	0.0017	0.0008	0.0271
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.0055	0.5531
Mycobacterium tuberculosis	Probable lipase LipD	0.0074	0.0089	0.0081
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.005	0.0055	0.58
Echinococcus granulosus	cytochrome P450 2K1	0.0017	0.0008	0.0056
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0035	0.3273
Echinococcus multilocularis	geminin	0.0349	0.0479	0.2017
Trypanosoma cruzi	hypothetical protein, conserved	0.0074	0.0089	1
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0013	0.06
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.0035	0.3273
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0046	0.0049	0.1212
Brugia malayi	Inositol-1	0.0036	0.0035	0.1127
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0074	0.0089	0.2885
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.005	0.0055	0.58
Trichomonas vaginalis	conserved hypothetical protein	0.0046	0.0049	0.4754
Brugia malayi	beta-lactamase family protein	0.0074	0.0089	0.2885
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.005	0.0055	0.58
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0035	0.2844
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0089	0.0081
Mycobacterium ulcerans	lipase LipD	0.0074	0.0089	0.0081
Trichomonas vaginalis	esterase, putative	0.0074	0.0089	1
Leishmania major	GTP-binding protein, putative	0.0021	0.0013	0.06
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0089	0.219
Schistosoma mansoni	transcription factor LCR-F1	0.0074	0.0089	0.1762
Brugia malayi	CHE-14 protein	0.0046	0.0049	0.1596
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0473	0.0656	0.0648
Echinococcus granulosus	expressed conserved protein	0.0101	0.0127	0.2562
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	0.004	0.004	0.1306
Schistosoma mansoni	serine/threonine protein kinase	0.005	0.0055	0.1046
Toxoplasma gondii	ABC1 family protein	0.0074	0.0089	1
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0074	0.0089	0.0081
Leishmania major	cytochrome p450-like protein	0.0026	0.002	0.1491
Loa Loa (eye worm)	cytochrome P450 family protein	0.0026	0.002	0.0502
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0107	0.0136	1
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.0035	0.0615
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0035	0.0615
Schistosoma mansoni	hypothetical protein	0.0044	0.0047	0.0872
Loa Loa (eye worm)	beta-lactamase	0.0074	0.0089	0.219
Schistosoma mansoni	metabotropic glutamate receptor	0.00367055	0.00218229	0.539184
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0035	0.2844
Schistosoma mansoni	hypothetical protein	0.0017	0.0008	0.0056
Plasmodium vivax	hypothetical protein, conserved	0.0074	0.0089	1
Brugia malayi	Niemann-Pick C1 protein precursor	0.0107	0.0136	0.4406
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0035	0.2844
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.005	0.0055	0.58
Loa Loa (eye worm)	cytochrome P450 family protein	0.0026	0.002	0.0502
Mycobacterium leprae	Probable transcriptional regulatory repressor protein (TetR-family) EthR	0.705438	1	0.5
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0013	0.06
Onchocerca volvulus		0.0074	0.0089	1
Brugia malayi	beta-lactamase	0.0074	0.0089	0.2885
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0021	0.0013	0.0032
Toxoplasma gondii	HEAT repeat-containing protein	0.0028	0.0024	0.1895
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0094	0.0118	0.2889
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0074	0.0089	0.0355
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0016	0.0391
Schistosoma mansoni	cytochrome P450	0.0017	0.0008	0.0056
Brugia malayi	Cytochrome P450 family protein	0.0026	0.002	0.0661
Mycobacterium ulcerans	AcrR family transcriptional regulator	0.705438	1	0.5
Echinococcus multilocularis	expressed conserved protein	0.0101	0.0127	0.0517
Schistosoma mansoni	hypothetical protein	0.0349	0.0479	1
Echinococcus granulosus	Protein patched homolog 1	0.0046	0.0049	0.0922
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0074	0.0089	0.1764

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 1.2 nM	Antimalarial activity was determined against the Chloroquine resistant strain FcB1 of Plasmodium falciparum	ChEMBL.	12182868
IC50 (functional)	= 1.2 nM	Antimalarial activity was determined against the Chloroquine resistant strain FcB1 of Plasmodium falciparum	ChEMBL.	12182868
IC50 (functional)	< 3 uM	Cytotoxicity tests were performed on a human diploid embryonic lung cell line (MRC5) using the colorimetric MTT assay	ChEMBL.	12182868
IC50 (functional)	< 3 uM	Cytotoxicity tests were performed on a human diploid embryonic lung cell line (MRC5) using the colorimetric MTT assay	ChEMBL.	12182868
Inhibition (functional)	> 80 %	Inhibition of Plasmodium falciparum growth at 10 nM	ChEMBL.	12182868
Inhibition (functional)	> 80 %	Inhibition of Plasmodium falciparum growth at 10 nM	ChEMBL.	12182868

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	12182868
Homo sapiens	ChEMBL23	12182868

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: CHEMBL89732
PubChem: 10416984

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 145255