TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 335.94 | Formula: C9H16CuN6S2++
H donors: 2 H acceptors: 0 LogP: 1.52 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CCNC1=N[N+]2=CC(=[N+]3[Cu]2(S1)SC(=N3)NCC)C
InChi: 1S/C9H18N6S2.Cu/c1-4-10-8(16)14-12-6-7(3)13-15-9(17)11-5-2;/h6H,4-5H2,1-3H3,(H2,10,14,16)(H2,11,15,17);/q;+4/p-2/b12-6+,13-7+;
InChiKey: SKGAPDKVEMLZTN-FSRDMIDLSA-L

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
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0031	0.0287	0.0287
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0042	0.0521	0.1646
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0118	0.2145	0.3041
Mycobacterium tuberculosis	Probable dehydrogenase	0.0118	0.2145	0.3041
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.1163	0.3678
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsA	0.0025	0.0153	0.0217
Echinococcus granulosus	thioredoxin glutathione reductase	0.0052	0.0724	0.229
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0287	0.0232
Trichomonas vaginalis	conserved hypothetical protein	0.003	0.0264	0.2114
Echinococcus multilocularis	transcription factor Dp 1	0.0042	0.0512	0.1618
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0041	0.0494	0.1562
Mycobacterium tuberculosis	Probable polyketide synthase Pks8	0.0025	0.0153	0.0217
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0042	0.0521	0.1646
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0072	0.1163	0.3678
Mycobacterium ulcerans	endonuclease IV	0.0084	0.1413	0.2003
Toxoplasma gondii	type I fatty acid synthase, putative	0.0025	0.0153	0.0484
Trypanosoma brucei	trypanothione reductase	0.0052	0.0724	0.229
Loa Loa (eye worm)	hypothetical protein	0.0486	1	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0042	0.0521	0.0738
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.0348	0.7053	1
Schistosoma mansoni	ap endonuclease	0.0021	0.0057	0.0179
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0042	0.0521	0.0738
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0131	0.2427	0.3441
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0057	0.008
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0021	0.0057	0.0179
Loa Loa (eye worm)	thioredoxin reductase	0.0052	0.0724	0.0671
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0118	0.2145	0.3041
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0057	0.008
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trypanosoma cruzi	DNA polymerase eta, putative	0.0041	0.0494	0.1562
Schistosoma mansoni	blooms syndrome DNA helicase	0.0029	0.0239	0.0755
Mycobacterium tuberculosis	Polyketide synthase Pks13	0.0025	0.0153	0.0217
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0334	0.0278
Brugia malayi	Bloom's syndrome protein homolog	0.0045	0.0581	0.0581
Loa Loa (eye worm)	hypothetical protein	0.0348	0.7053	0.7037
Schistosoma mansoni	ap endonuclease	0.0021	0.0057	0.0179
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0031	0.0287	0.0232
Trichomonas vaginalis	DNA polymerase eta, putative	0.0042	0.0521	0.4168
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trichomonas vaginalis	conserved hypothetical protein	0.0043	0.0531	0.4254
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0042	0.0521	0.1646
Loa Loa (eye worm)	RecQ helicase	0.0045	0.0581	0.0527
Mycobacterium ulcerans	fatty acid synthase Fas	0.0025	0.0153	0.0217
Mycobacterium tuberculosis	Probable fatty acid synthase Fas (fatty acid synthetase)	0.0025	0.0153	0.0217
Echinococcus granulosus	transcription factor Dp 1	0.0042	0.0512	0.1618
Toxoplasma gondii	type I fatty acid synthase, putative	0.0025	0.0153	0.0484
Schistosoma mansoni	DNA helicase recq5	0.0031	0.0287	0.0907
Brugia malayi	Hypothetical 29.7 kDa protein C05D11.5 in chromosome III	0.0022	0.0088	0.0088
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0131	0.2427	0.3441
Loa Loa (eye worm)	hypothetical protein	0.0486	1	1
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.1163	0.3678
Trichomonas vaginalis	ap endonuclease, putative	0.0021	0.0057	0.0454
Trypanosoma cruzi	DNA polymerase eta, putative	0.007	0.1118	0.3534
Brugia malayi	glutathione reductase	0.0052	0.0724	0.0724
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsC	0.0025	0.0153	0.0217
Plasmodium vivax	apurinic/apyrimidinic endonuclease Apn1, putative	0.0084	0.1413	0.2003
Mycobacterium tuberculosis	Probable polyketide synthase Pks5	0.0025	0.0153	0.0217
Loa Loa (eye worm)	hypothetical protein	0.007	0.1118	0.1067
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0057	0.0179
Echinococcus multilocularis	chromobox protein 1	0.0076	0.1249	0.395
Mycobacterium tuberculosis	Probable polyketide synthase Pks15	0.0025	0.0153	0.0217
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Mycobacterium ulcerans	polyketide synthase	0.0025	0.0153	0.0217
Entamoeba histolytica	fatty acid elongase, putative	0.0045	0.0582	0.4744
Echinococcus granulosus	chromobox protein 1	0.0076	0.1249	0.395
Trypanosoma cruzi	beta-ketoacyl synthase family protein, putative	0.0166	0.3163	1
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0072	0.1163	0.3678
Entamoeba histolytica	fatty acid elongase, putative	0.0045	0.0582	0.4744
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0521	0.1646
Trichomonas vaginalis	conserved hypothetical protein	0.003	0.0264	0.2114
Trypanosoma brucei	beta-ketoacyl-ACP synthase	0.0166	0.3163	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0034	0.0348	0.1099
Trichomonas vaginalis	conserved hypothetical protein	0.0043	0.0531	0.4254
Toxoplasma gondii	endonuclease IV APN	0.0084	0.1413	0.4467
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0042	0.0521	0.1646
Mycobacterium ulcerans	polyketide synthase Pks13	0.0025	0.0153	0.0217
Schistosoma mansoni	DNA polymerase eta	0.007	0.1118	0.3534
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0057	0.0179
Mycobacterium leprae	Polyketide synthase Pks13	0.0025	0.0153	0.0254
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0031	0.0287	0.0287
Mycobacterium tuberculosis	Probable reductase	0.0118	0.2145	0.3041
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0021	0.0057	1
Onchocerca volvulus		0.0034	0.0334	0.0247
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0042	0.0521	0.4168
Toxoplasma gondii	exonuclease III APE	0.0021	0.0057	0.0179
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0022	0.0088	0.0125
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0031	0.0287	0.0907
Loa Loa (eye worm)	glutathione reductase	0.0052	0.0724	0.0671
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0031	0.0287	0.0907
Mycobacterium tuberculosis	Probable polyketide synthase Pks9	0.0025	0.0153	0.0217
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0042	0.0521	0.0467
Plasmodium falciparum	thioredoxin reductase	0.0052	0.0724	0.1027
Mycobacterium ulcerans	polyketide synthase MbtC	0.0025	0.0153	0.0217
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0025	0.0153	0.0217
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0021	0.0057	0.109
Mycobacterium ulcerans	polyketide synthase	0.0025	0.0153	0.0217
Entamoeba histolytica	fatty acid elongase, putative	0.0045	0.0582	0.4744
Loa Loa (eye worm)	hypothetical protein	0.0084	0.1413	0.1364
Trypanosoma brucei	DNA polymerase kappa, putative	0.0029	0.024	0.0758
Toxoplasma gondii	thioredoxin reductase	0.0052	0.0724	0.229
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.0031	0.0287	0.0407
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC	0.0025	0.0153	0.0254
Brugia malayi	Heterochromatin protein 1	0.0076	0.1249	0.1249
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0063	0.0961	0.3038
Leishmania major	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Brugia malayi	hypothetical protein	0.0133	0.247	0.247
Trichomonas vaginalis	chromobox protein, putative	0.0076	0.1249	1
Chlamydia trachomatis	endonuclease IV	0.0084	0.1413	0.2003
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0021	0.0057	0.008
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0521	0.1646
Wolbachia endosymbiont of Brugia malayi	3-oxoacyl-ACP synthase	0.0166	0.3163	0.4485
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0131	0.2427	0.9215
Brugia malayi	exodeoxyribonuclease III family protein	0.0021	0.0057	0.0057
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsB	0.0025	0.0153	0.0217
Trypanosoma brucei	DNA polymerase eta, putative	0.007	0.1118	0.3534
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0118	0.2145	0.3041
Mycobacterium tuberculosis	Polyketide synthetase MbtC (polyketide synthase)	0.0025	0.0153	0.0217
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE	0.0025	0.0153	0.0254
Trypanosoma brucei	DNA polymerase kappa, putative	0.0029	0.024	0.0758
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0034	0.0348	0.1099
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0063	0.0961	0.3038
Echinococcus multilocularis	Protein lozenge	0.0061	0.0918	0.2904
Schistosoma mansoni	lozenge	0.0061	0.0918	0.2904
Brugia malayi	chromobox protein homolog 3	0.0043	0.0531	0.0531
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0521	0.0738
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0052	0.0724	0.1027
Leishmania major	DNA polymerase eta, putative	0.007	0.1118	0.3534
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0072	0.1163	0.3678
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0063	0.0961	0.0961
Loa Loa (eye worm)	runx1	0.0061	0.0918	0.0867
Onchocerca volvulus		0.0486	1	1
Echinococcus multilocularis	dna polymerase kappa	0.0042	0.0521	0.1646
Leishmania major	DNA polymerase eta, putative	0.0041	0.0494	0.1562
Trichomonas vaginalis	chromobox protein, putative	0.0046	0.0601	0.4811
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0021	0.0057	0.008
Mycobacterium ulcerans	epimerase	0.0022	0.0088	0.0125
Leishmania major	trypanothione reductase	0.0052	0.0724	0.229
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0042	0.052	0.0737
Entamoeba histolytica	fatty acid elongase, putative	0.0045	0.0582	0.4744
Schistosoma mansoni	3-oxoacyl-[ACP] synthase	0.0166	0.3163	1
Giardia lamblia	Sgs1 DNA helicase, putative	0.0031	0.0287	0.5511
Trypanosoma brucei	unspecified product	0.0042	0.0521	0.1646
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0063	0.0961	0.1362
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0521	0.0738
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0072	0.1163	1
Plasmodium vivax	beta-ketoacyl-acyl carrier protein synthase III precursor, putative	0.0348	0.7053	1
Mycobacterium ulcerans	hypothetical protein	0.0022	0.0088	0.0125
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB	0.0025	0.0153	0.0254
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0118	0.2145	0.3041
Mycobacterium leprae	3-oxoacyl-[acyl-carrier-protein] synthase 1 KasA (BETA-KETOACYL-ACP SYNTHASE) (KAS I)	0.0141	0.2626	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Onchocerca volvulus	Fatty acid synthase homolog	0.0025	0.0153	0.0065
Chlamydia trachomatis	oxoacyl-ACP synthase III	0.0348	0.7053	1
Mycobacterium ulcerans	polyketide synthase Pks9	0.0025	0.0153	0.0217
Mycobacterium tuberculosis	Polyketide synthase Pks2	0.0025	0.0153	0.0217
Mycobacterium leprae	3-oxoacyl-[acyl-carrier-protein] synthase 2 KasB (BETA-KETOACYL-ACP SYNTHASE) (KAS I)	0.0141	0.2626	1
Brugia malayi	ImpB/MucB/SamB family protein	0.007	0.1118	0.1118
Echinococcus granulosus	chromobox protein 1	0.0076	0.1249	0.395
Brugia malayi	Beta-ketoacyl synthase, N-terminal domain containing protein	0.0166	0.3163	0.3163
Toxoplasma gondii	beta-ketoacyl synthase, N-terminal domain-containing protein	0.0025	0.0153	0.0484
Trypanosoma cruzi	beta-ketoacyl synthase family protein, putative	0.0166	0.3163	1
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0063	0.0961	0.3038
Echinococcus granulosus	dna polymerase kappa	0.0042	0.0521	0.1646
Plasmodium falciparum	apurinic/apyrimidinic endonuclease Apn1, putative	0.0084	0.1413	0.2003
Schistosoma mansoni	chromobox protein	0.0076	0.1249	0.395
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0021	0.0057	0.008
Trypanosoma cruzi	trypanothione reductase, putative	0.0052	0.0724	0.229
Toxoplasma gondii	3-oxoacyl-acyl-carrier protein synthase I/II, putative	0.0166	0.3163	1
Echinococcus multilocularis	dna polymerase eta	0.007	0.1118	0.3534
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0031	0.0287	0.0907
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsD	0.0025	0.0153	0.0217
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Plasmodium vivax	3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative	0.0166	0.3163	0.4485
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.0348	0.7053	1
Mycobacterium leprae	Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas	0.0025	0.0153	0.0254
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0034	0.0348	0.1099
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsE	0.0025	0.0153	0.0217
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0052	0.0724	0.229
Mycobacterium ulcerans	3-oxoacyl-(acyl carrier protein) synthase II	0.0166	0.3163	0.4485
Schistosoma mansoni	chromobox protein	0.0076	0.1249	0.395
Brugia malayi	DNA-(Apurinic or apyrimidinic site) lyase	0.0084	0.1413	0.1413
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0521	0.1646
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsA	0.0025	0.0153	0.0217
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.1163	0.3678
Echinococcus multilocularis	bloom syndrome protein	0.0045	0.0581	0.1836
Mycobacterium tuberculosis	Probable endonuclease IV End (endodeoxyribonuclease IV) (apurinase)	0.0084	0.1413	0.2003
Trypanosoma brucei	unspecified product	0.0029	0.024	0.0758
Giardia lamblia	DINP protein human, muc B family	0.0042	0.0521	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0029	0.024	0.0758
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0021	0.0057	0.0179
Toxoplasma gondii	AMP-binding enzyme domain-containing protein	0.0025	0.0153	0.0484
Plasmodium vivax	ADP-dependent DNA helicase RecQ, putative	0.0027	0.0191	0.0271
Mycobacterium ulcerans	beta-ketoacyl synthase-like protein	0.0348	0.7053	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0153	0.0097
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0063	0.0961	0.1362
Trypanosoma brucei	unspecified product	0.0029	0.024	0.0758
Mycobacterium tuberculosis	3-oxoacyl-[acyl-carrier protein] synthase 2 KasB (beta-ketoacyl-ACP synthase) (KAS I)	0.0141	0.2626	0.3723
Mycobacterium leprae	PROBABLE ENDONUCLEASE IV END (ENDODEOXYRIBONUCLEASE IV) (APURINASE)	0.0084	0.1413	0.5219
Entamoeba histolytica	fatty acid elongase, putative	0.0045	0.0582	0.4744
Plasmodium falciparum	3-oxoacyl-acyl-carrier protein synthase I/II	0.0166	0.3163	0.4485
Mycobacterium ulcerans	sugar phosphate isomerases/epimerases	0.0022	0.0088	0.0125
Trichomonas vaginalis	ap endonuclease, putative	0.0021	0.0057	0.0454
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0042	0.0521	0.4192
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0025	0.0153	0.0217
Entamoeba histolytica	recQ family helicase, putative	0.0034	0.0348	0.2629
Brugia malayi	Beta-ketoacyl synthase, N-terminal domain containing protein	0.0025	0.0153	0.0153
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0072	0.1163	0.1163
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0153	0.0097
Mycobacterium tuberculosis	Probable oxidoreductase	0.0131	0.2427	0.3441
Loa Loa (eye worm)	hypothetical protein	0.003	0.0252	0.0196
Echinococcus multilocularis	chromobox protein 1	0.0076	0.1249	0.395
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0031	0.0287	0.0907
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0042	0.0521	0.1646
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA	0.0025	0.0153	0.0254
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0025	0.0153	0.0153
Mycobacterium tuberculosis	Polyketide synthase Pks12	0.0025	0.0153	0.0217
Echinococcus multilocularis	3 oxoacyl (acyl carrier protein) synthase	0.0166	0.3163	1
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0063	0.0961	0.1362
Mycobacterium tuberculosis	Probable polyketide synthase Pks7	0.0025	0.0153	0.0217
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0118	0.2145	0.8103
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0072	0.1163	0.3678
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0021	0.0057	0.0179
Leishmania major	beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative	0.0166	0.3163	1
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0031	0.0287	0.0907
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0531	0.0477
Echinococcus granulosus	bloom syndrome protein	0.0045	0.0581	0.1836
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0043	0.0531	0.0447
Echinococcus granulosus	3 oxoacyl acyl carrier protein synthase	0.0166	0.3163	1
Trichomonas vaginalis	chromobox protein, putative	0.0076	0.1249	1
Mycobacterium tuberculosis	3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III)	0.0348	0.7053	1
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsD	0.0025	0.0153	0.0217
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD	0.0025	0.0153	0.0254
Echinococcus granulosus	dna polymerase eta	0.007	0.1118	0.3534
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0063	0.0961	0.3038
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Plasmodium falciparum	beta-ketoacyl-ACP synthase III	0.0348	0.7053	1
Trichomonas vaginalis	DNA helicase recq, putative	0.0034	0.0348	0.2784
Mycobacterium tuberculosis	Probable multifunctional mycocerosic acid synthase membrane-associated Mas	0.0025	0.0153	0.0217
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0031	0.0287	0.0907
Trichomonas vaginalis	DNA helicase recq1, putative	0.0045	0.0581	0.4649
Wolbachia endosymbiont of Brugia malayi	3-oxoacyl-ACP synthase	0.0348	0.7053	1
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0026	0.0178	0.0562
Trichomonas vaginalis	DNA helicase recq, putative	0.0045	0.0581	0.4649
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0059	0.087	0.0818
Brugia malayi	Thioredoxin reductase	0.0052	0.0724	0.0724
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0046	0.0601	0.0517
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Trichomonas vaginalis	chromobox protein, putative	0.0046	0.0601	0.4811
Mycobacterium tuberculosis	Probable membrane bound polyketide synthase Pks6	0.0025	0.0153	0.0217
Plasmodium falciparum	glutathione reductase	0.0052	0.0724	0.1027
Onchocerca volvulus		0.0025	0.0153	0.0065
Schistosoma mansoni	DNA helicase recq1	0.0031	0.0287	0.0907
Brugia malayi	ImpB/MucB/SamB family protein	0.0042	0.0521	0.0521
Loa Loa (eye worm)	beta-ketoacyl synthase domain-containing protein	0.0166	0.3163	0.3124
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0088	0.0032
Mycobacterium leprae	PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE)	0.0025	0.0153	0.0254
Mycobacterium leprae	Probable polyketide synthase Pks1	0.0025	0.0153	0.0254
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0521	0.1646
Loa Loa (eye worm)	heterochromatin protein 1	0.0076	0.1249	0.1199
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsC	0.0025	0.0153	0.0217
Mycobacterium ulcerans	multifunctional mycocerosic acid synthase membrane-associated Mas	0.0025	0.0153	0.0217
Chlamydia trachomatis	3-oxoacyl-ACP synthase	0.0166	0.3163	0.4485
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0025	0.0153	0.0217
Plasmodium vivax	thioredoxin reductase, putative	0.0052	0.0724	0.1027
Plasmodium vivax	glutathione reductase, putative	0.0052	0.0724	0.1027
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0072	0.1163	0.1113
Mycobacterium ulcerans	3-oxoacyl-(acyl carrier protein) synthase II	0.0166	0.3163	0.4485
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0021	0.0057	0.0179
Mycobacterium tuberculosis	3-oxoacyl-[acyl-carrier protein] synthase 1 KasA (beta-ketoacyl-ACP synthase) (KAS I)	0.0141	0.2626	0.3723

Activities

Activity type	Activity value	Assay description	Source	Reference
Injected dose (functional)	= 1.2 %	Myocardial levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 1.7 %	Myocardial levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 1.7 %	Pulmonary levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 1.8 %	Brain levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 1.9 %	Myocardial levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 2 %	Brain levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 2.2 %	Kidney levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 2.7 %	Brain levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 3 %	Kidney levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 4.2 %	Pulmonary levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 4.6 %	Kidney levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 5.2 %	Blood levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 6.7 %	Blood levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 7.4 %	Pulmonary levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 8.5 %	Blood levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 14.5 %	Liver levels of tracer copper in rats 1 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 18.9 %	Liver levels of tracer copper in rats 5 min after injection into the femoral vein	ChEMBL.	2342070
Injected dose (functional)	= 19.1 %	Liver levels of tracer copper in rats 2 hr after injection into the femoral vein	ChEMBL.	2342070
logP (ADMET)	= 2.76	Partition coefficient (logP)	ChEMBL.	2342070

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: 175299

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 70897