TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 594.723 | Formula: C34H34N4O4S
H donors: 3 H acceptors: 5 LogP: 6.81 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: O=C(C(NC(=O)c1ccc2c(c1)n(C)c(c2C1CCCCC1)c1ccccn1)(C)C)Nc1ccc2c(c1)cc(s2)C(=O)O
InChi: 1S/C34H34N4O4S/c1-34(2,33(42)36-23-13-15-27-22(17-23)19-28(43-27)32(40)41)37-31(39)21-12-14-24-26(18-21)38(3)30(25-11-7-8-16-35-25)29(24)20-9-5-4-6-10-20/h7-8,11-20H,4-6,9-10H2,1-3H3,(H,36,42)(H,37,39)(H,40,41)
InChiKey: KURLFVGLMMUDNB-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
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0019	0.0285	0.0285
Trichomonas vaginalis	ran, putative	0.0023	0.0429	0.0645
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.02	0.0579
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.1116	0.1116
Onchocerca volvulus		0.0019	0.0285	0.0758
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0261	0.0261
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0016	0.022	0.022
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0285	0.0285
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0017	0.025	0.025
Trypanosoma cruzi	trypanothione reductase, putative	0.0047	0.1163	1
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.0286	0.0761
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0023	0.0429	0.3367
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0019	0.0285	0.0824
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.1653	0.1653
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Schistosoma mansoni	importin beta-1	0.0032	0.0683	0.0683
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0017	0.025	0.0656
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0108	0.3011	0.8895
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0025	0.0071
Trypanosoma brucei	cytochrome P450, putative	0.002	0.0334	0.2508
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.001	0.0025	0.0071
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0017	0.025	0.025
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.1116	0.1116
Leishmania major	importin beta-1 subunit, putative	0.0026	0.0501	0.4019
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.001	0.0025	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Brugia malayi	Cation transporter family protein	0.0019	0.0285	0.0824
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0286	0.0286
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.1116	0.3228
Plasmodium vivax	importin-beta 2, putative	0.0032	0.0683	0.4912
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0286	0.069
Echinococcus granulosus	tar DNA binding protein	0.0064	0.1653	0.1653
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.02	0.02
Plasmodium vivax	thioredoxin reductase, putative	0.0047	0.1163	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Echinococcus granulosus	nAChR subunit	0.001	0.0025	0.0025
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0019	0.0285	0.0285
Schistosoma mansoni	hypothetical protein	0.017	0.489	0.489
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0019	0.0285	0.0285
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0017	0.025	0.0722
Echinococcus granulosus	importin subunit beta 1	0.0032	0.0683	0.0683
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.022	0.148
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0016	0.022	0.022
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0444	0.3025
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0108	0.3011	0.8895
Echinococcus multilocularis		0.0011	0.0057	0.0057
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0017	0.025	0.025
Entamoeba histolytica	glycogen phosphorylase, putative	0.0053	0.1336	0.3821
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0017	0.025	0.025
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0285	0.0285
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0017	0.025	0.025
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0285	0.0285
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0286	0.207
Loa Loa (eye worm)	transcription factor SMAD2	0.012	0.3363	0.3363
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Mycobacterium tuberculosis	Probable glycogen phosphorylase GlgP	0.0053	0.1336	0.3852
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0017	0.025	0.0722
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0285	0.0285
Schistosoma mansoni	coup transcription factor	0.0017	0.025	0.025
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0444	0.3499
Brugia malayi	TAR-binding protein	0.0064	0.1653	0.4781
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0286	0.0202
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1116	0.1116
Schistosoma mansoni	retinoic acid receptor RXR	0.0017	0.025	0.025
Schistosoma mansoni	ap endonuclease	0.0019	0.0286	0.0286
Loa Loa (eye worm)	hypothetical protein	0.0016	0.02	0.02
Brugia malayi	Cytochrome P450 family protein	0.002	0.0334	0.0966
Schistosoma mansoni	hypothetical protein	0.0016	0.02	0.02
Loa Loa (eye worm)	hypothetical protein	0.005	0.1236	0.1236
Loa Loa (eye worm)	GABA receptor subunit	0.001	0.0025	0.0025
Loa Loa (eye worm)	LGC-31 protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0047	0.1163	0.1163
Echinococcus granulosus	Glycosyl transferase family 35	0.0123	0.3458	0.3458
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0285	0.0824
Mycobacterium ulcerans	glycogen phosphorylase GlgP	0.0053	0.1336	1
Echinococcus multilocularis	Glycosyl transferase, family 35	0.0123	0.3458	0.3458
Onchocerca volvulus	Glycogen phosphorylase homolog	0.0123	0.3458	1
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0016	0.022	0.148
Loa Loa (eye worm)	steroid hormone receptor	0.0017	0.025	0.025
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0285	0.0285
Brugia malayi	RNA binding protein	0.0064	0.1653	0.4781
Loa Loa (eye worm)	cytochrome P450 family protein	0.002	0.0334	0.0334
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0285	0.0285
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0017	0.025	0.0722
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.02	0.02
Trypanosoma cruzi	cytochrome P450, putative	0.002	0.0334	0.2508
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0016	0.022	0.0493
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0285	0.0824
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Schistosoma mansoni	glycogen phosphorylase	0.0123	0.3458	0.3458
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0026	0.0501	0.0868
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0023	0.0429	0.0429
Schistosoma mansoni	hypothetical protein	0.0016	0.02	0.02
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0285	0.0285
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0285	0.0285
Trypanosoma brucei	importin beta-1 subunit, putative	0.0032	0.0683	0.5665
Loa Loa (eye worm)	cytochrome P450	0.0011	0.0057	0.0057
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0018	0.0261	0.1596
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0444	0.3025
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0444	0.1221
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0108	0.3011	0.8895
Schistosoma mansoni	ran	0.0023	0.0429	0.0429
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.02	0.02
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0057	0.0164
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0017	0.025	0.0722
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0123	0.3458	1
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0261	0.0261
Echinococcus granulosus	FTZ F1 alpha	0.0017	0.025	0.025
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0444	0.1221
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0023	0.0429	0.3367
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0017	0.025	0.0722
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0023	0.0429	0.0429
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0231	0.0526
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0286	0.0693
Schistosoma mansoni	RAR-like nuclear receptor	0.0017	0.025	0.025
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Echinococcus granulosus	geminin	0.017	0.489	0.489
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0019	0.0285	0.0285
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Onchocerca volvulus		0.0024	0.0444	0.1221
Echinococcus granulosus	cytochrome P450 2K1	0.0011	0.0057	0.0057
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	glycogen phosphorylase	0.0123	0.3458	0.3458
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0231	0.0526
Brugia malayi	Cation transporter family protein	0.0019	0.0285	0.0824
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0231	0.0526
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0019	0.0285	0.0824
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0285	0.0285
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0286	0.0202
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	MH2 domain-containing protein	0.012	0.3363	0.3363
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0285	0.0285
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0444	0.1165
Mycobacterium tuberculosis	Probable dehydrogenase	0.0108	0.3011	0.8895
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0019	0.0285	0.0285
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0444	0.1221
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0286	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0017	0.025	0.025
Entamoeba histolytica	Ran family GTPase	0.0023	0.0429	0.1179
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0017	0.025	0.0722
Trypanosoma cruzi	trypanothione reductase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	glutathione reductase	0.0047	0.1163	0.1163
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.02	0.0579
Brugia malayi	Thioredoxin reductase	0.0047	0.1163	0.3364
Brugia malayi	RNA, U transporter 1	0.009	0.2459	0.7111
Mycobacterium tuberculosis	Probable reductase	0.0108	0.3011	0.8895
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0444	0.1165
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0444	0.1284
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0019	0.0285	0.0285
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.1116	0.1116
Schistosoma mansoni	thyroid hormone receptor	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0261	0.0261
Schistosoma mansoni	thyroid hormone receptor	0.0017	0.025	0.025
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0261	0.043
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0444	0.1284
Plasmodium falciparum	thioredoxin reductase	0.0047	0.1163	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.1116	0.1116
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0286	0.207
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1116	0.1116
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0017	0.025	0.025
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0017	0.025	0.025
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0108	0.3011	0.8895
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0444	0.3025
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0444	0.3025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Onchocerca volvulus		0.0019	0.0285	0.0758
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0016	0.022	0.148
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0285	0.0285
Schistosoma mansoni	hypothetical protein	0.0016	0.02	0.02
Plasmodium falciparum	importin beta, putative	0.0032	0.0683	0.4912
Leishmania major	trypanothione reductase	0.0047	0.1163	1
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0285	0.0285
Onchocerca volvulus	Putative nachr subunit	0.0019	0.0285	0.0758
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0019	0.0285	0.0285
Schistosoma mansoni	hypothetical protein	0.017	0.489	0.489
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0023	0.0429	0.0429
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.012	0.3378	1
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.0286	0.0202
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Schistosoma mansoni	neurotransmitter gated ion channel	0.001	0.0025	0.0025
Toxoplasma gondii	NADPH-glutathione reductase	0.0016	0.022	0.148
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	thioredoxin reductase	0.0047	0.1163	0.1163
Mycobacterium tuberculosis	Probable oxidoreductase	0.012	0.3378	1
Entamoeba histolytica	glycogen phosphorylase, putative	0.0123	0.3458	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0231	0.0526
Echinococcus multilocularis	glycogen phosphorylase	0.0123	0.3458	0.3458
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0019	0.0285	0.0285
Brugia malayi	nuclear receptor NHR-88	0.0017	0.025	0.0722
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0016	0.022	0.1279
Trypanosoma brucei	trypanothione reductase	0.0047	0.1163	1
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Brugia malayi	carbohydrate phosphorylase	0.0123	0.3458	1
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0023	0.0429	0.2215
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0285	0.0285
Schistosoma mansoni	glycogen phosphorylase	0.0053	0.1336	0.1336
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0019	0.0285	0.0285
Toxoplasma gondii	HEAT repeat-containing protein	0.0032	0.0683	0.5665
Echinococcus multilocularis	importin subunit beta 1	0.0032	0.0683	0.0683
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0444	0.1284
Brugia malayi	Nuclear hormone receptor-like 1	0.0017	0.025	0.0722
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0017	0.025	0.0722
Onchocerca volvulus		0.0019	0.0285	0.0758
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.002	0.0334	0.2168
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0286	0.207
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0444	0.3499
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Entamoeba histolytica	hypothetical protein	0.0026	0.0501	0.1389
Echinococcus granulosus	GPCR family 2	0.0016	0.02	0.02
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0023	0.0429	0.0645
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0017	0.025	0.025
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0026	0.0501	0.4019
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0019	0.0285	0.0285
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0444	0.3025
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0019	0.0285	0.0824
Echinococcus multilocularis	nAChR subunit	0.001	0.0025	0.0025
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0018	0.0261	0.0125
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0757	0.0757
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0017	0.025	0.0722
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0444	0.0444
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0025	0.0071
Onchocerca volvulus	Bile acid receptor homolog	0.0017	0.025	0.0656
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.1116	0.1116
Entamoeba histolytica	glycogenphosphorylase, putative	0.0053	0.1336	0.3821
Loa Loa (eye worm)	cytochrome P450 family protein	0.0051	0.1265	0.1265
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Onchocerca volvulus		0.0019	0.0285	0.0758
Brugia malayi	Importin beta-1 subunit	0.0032	0.0683	0.1977
Brugia malayi	glutathione reductase	0.0047	0.1163	0.3364
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.1653	0.1653
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0019	0.0285	0.0824
Echinococcus granulosus	thioredoxin glutathione reductase	0.0047	0.1163	0.1163
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.022	0.148
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0016	0.022	0.1279
Toxoplasma gondii	exonuclease III APE	0.0019	0.0286	0.207
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0285	0.0824
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0016	0.022	0.0637
Schistosoma mansoni	hypothetical protein	0.0011	0.0057	0.0057
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0261	0.0261
Entamoeba histolytica	glycogen phosphorylase, putative	0.0123	0.3458	1
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.1653	0.1653
Trypanosoma brucei	importin beta-1 subunit, putative	0.0032	0.0683	0.5665
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0017	0.025	0.025
Echinococcus granulosus	glycogen phosphorylase	0.0123	0.3458	0.3458
Loa Loa (eye worm)	CYP4Cod1	0.002	0.0334	0.0334
Brugia malayi	Cytochrome P450 family protein	0.002	0.0334	0.0966
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0017	0.025	0.0722
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.001	0.0025	0.0071
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0017	0.025	0.025
Leishmania major	GTP-binding protein, putative	0.0023	0.0429	0.3367
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0261	0.0261
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0017	0.025	0.025
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0016	0.022	0.148
Brugia malayi	Steroid receptor seven-up type 2	0.0017	0.025	0.0722
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.012	0.3378	1
Schistosoma mansoni	hypothetical protein	0.0016	0.02	0.02
Schistosoma mansoni	cytochrome P450	0.0011	0.0057	0.0057
Schistosoma mansoni	ap endonuclease	0.0019	0.0286	0.0286
Loa Loa (eye worm)	cytochrome P450 family protein	0.002	0.0334	0.0334
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0017	0.025	0.025
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0012	0.0088	0.0254
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0286	0.0286
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0017	0.025	0.025
Brugia malayi	MH2 domain containing protein	0.012	0.3363	0.9725
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0444	0.3025
Brugia malayi	steroid hormone receptor	0.0017	0.025	0.0722
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0444	0.1165
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0019	0.0285	0.0285
Schistosoma mansoni	glycogen phosphorylase	0.0123	0.3458	0.3458
Schistosoma mansoni	ran	0.0023	0.0429	0.0429
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.1653	0.1653
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0047	0.1163	0.3331
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Onchocerca volvulus		0.0017	0.025	0.0656
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0017	0.025	0.025
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0016	0.022	0.022
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.02	0.02
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Echinococcus multilocularis	geminin	0.017	0.489	0.489
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0019	0.0285	0.0285
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.1236	0.1236
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0683	0.0683
Brugia malayi	cytochrome P450	0.0011	0.0057	0.0164
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.1653	0.1653
Plasmodium vivax	glutathione reductase, putative	0.0047	0.1163	1
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0016	0.022	0.148
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0286	0.179
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0023	0.0429	0.1241
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0019	0.0285	0.0824
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Chlamydia trachomatis	glycogen phosphorylase	0.0123	0.3458	1
Echinococcus multilocularis	FTZ F1 alpha	0.0017	0.025	0.025
Schistosoma mansoni	nuclear hormone receptor	0.0017	0.025	0.025
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1116	0.1116
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0285	0.0824
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0017	0.025	0.0722
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Echinococcus multilocularis	tar DNA binding protein	0.0064	0.1653	0.1653
Echinococcus multilocularis	nAChR subunit	0.0019	0.0285	0.0285
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Brugia malayi	nuclear hormone receptor	0.0017	0.025	0.0722
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0064	0.1653	0.1653
Brugia malayi	Cation transporter family protein	0.0019	0.0285	0.0824
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0444	0.3025
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.001	0.0025	0.0025
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0444	0.0444
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0444	0.3025
Brugia malayi	ecdysteroid receptor	0.0017	0.025	0.0722
Schistosoma mansoni	nAChR subunit	0.0019	0.0285	0.0285
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0017	0.025	0.025
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.02	0.02
Brugia malayi	RNA recognition motif domain containing protein	0.0064	0.1653	0.4781
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0017	0.025	0.025
Plasmodium falciparum	glutathione reductase	0.0047	0.1163	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.025
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0757	0.2188
Trichomonas vaginalis	importin beta-1, putative	0.0026	0.0501	0.0868
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0285	0.0285
Onchocerca volvulus	Protein ultraspiracle homolog	0.0017	0.025	0.0656
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0017	0.025	0.025
Echinococcus granulosus	ecdysone induced protein 78C	0.0017	0.025	0.025
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0017	0.025	0.025
Brugia malayi	photoreceptor-specific nuclear receptor	0.0017	0.025	0.0722
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0017	0.025	0.025
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0016	0.022	0.148
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0444	0.0444
Leishmania major	cytochrome p450-like protein	0.002	0.0334	0.2508
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0023	0.0429	0.3367
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0023	0.0429	0.2215
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0019	0.0285	0.0824
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.022	0.148
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0285	0.0285
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.1236	0.3575
Giardia lamblia	Glycogen phosphorylase	0.0123	0.3458	1
Echinococcus multilocularis	glycogen phosphorylase	0.0123	0.3458	0.3458
Loa Loa (eye worm)	RNA binding protein	0.0064	0.1653	0.1653
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0123	0.3458	1
Echinococcus granulosus	nAChR subunit	0.0019	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0285	0.0285
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0017	0.025	0.0722
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0017	0.025	0.025
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.022	0.148
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0285	0.0285
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0286	0.0826
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.1236	0.3575
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0444	0.3499
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0023	0.0429	0.3367
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0016	0.022	0.1279
Loa Loa (eye worm)	TAR-binding protein	0.0064	0.1653	0.1653
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0261	0.0615
Echinococcus granulosus	glycogen phosphorylase	0.0123	0.3458	0.3458
Onchocerca volvulus		0.0019	0.0285	0.0758
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0261	0.043
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0026	0.0501	0.0868
Brugia malayi	Cytochrome P450 family protein	0.0051	0.1265	0.3659
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.001	0.0025	0.0025
Echinococcus multilocularis	GPCR, family 2	0.0016	0.02	0.02
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0286	0.0286
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0017	0.025	0.0722
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0019	0.0285	0.0824
Toxoplasma gondii	thioredoxin reductase	0.0047	0.1163	1
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.012	0.3378	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Brugia malayi	excitatory GABA receptor EXP-1A	0.0019	0.0285	0.0824
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0444	0.1165
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0017	0.025	0.025
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0017	0.025	0.025
Trypanosoma cruzi	cytochrome P450, putative	0.002	0.0334	0.2508
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0017	0.025	0.0722
Echinococcus multilocularis	ecdysone induced protein 78C	0.0017	0.025	0.025
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0285	0.0285
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0012	0.0088	0.0254
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0017	0.025	0.025
Schistosoma mansoni	hypothetical protein	0.0034	0.0757	0.0757
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0285	0.0285
Entamoeba histolytica	glycogen phosphorylase, putative	0.0053	0.1336	0.3821
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0017	0.025	0.025
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0286	1
Onchocerca volvulus		0.0019	0.0285	0.0758
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0286	0.0693
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0286	0.207
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0017	0.025	0.025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0285
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0108	0.3011	0.8895

Activities

Activity type	Activity value	Assay description	Source	Reference
permeability (ADMET)	= 0.4 10'-6 cm/s	Permeability across apical to basolateral side in human Caco2 cells	ChEMBL.	21592789

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.

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External resources for this compound

ChEMBL: CHEMBL1778502

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1512615