Detailed information for compound 73473

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 335.94 | Formula: C9H16CuN6S2++
  • H donors: 2 H acceptors: 0 LogP: 1.83 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNC1=N[N+]2=CC(=[N+]3[Cu]2(S1)SC(=N3)NC)C(C)C
  • InChi: 1S/C9H18N6S2.Cu/c1-6(2)7(13-15-9(17)11-4)5-12-14-8(16)10-3;/h5-6H,1-4H3,(H2,10,14,16)(H2,11,15,17);/q;+4/p-2/b12-5+,13-7-;
  • InChiKey: WVERLVVCXHICDI-SZUYZVRDSA-L  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi DNA polymerase kappa, putative 0.0042 0.0336 0.0729
Echinococcus multilocularis dna polymerase kappa 0.0042 0.0336 0.0289
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier protein] synthase 2 KasB (beta-ketoacyl-ACP synthase) (KAS I) 0.0141 0.2482 0.3223
Toxoplasma gondii flavodoxin domain-containing protein 0.0102 0.1649 0.5289
Schistosoma mansoni diflavin oxidoreductase 0.0102 0.1649 0.1642
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0079 0.1137 0.2801
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Trypanosoma brucei DNA polymerase eta, putative 0.007 0.0945 0.2314
Schistosoma mansoni cytochrome P450 reductase 0.0207 0.3918 0.397
Plasmodium vivax thioredoxin reductase, putative 0.0052 0.0544 0.0777
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0042 0.0336 0.0469
Trichomonas vaginalis DNA polymerase eta, putative 0.0042 0.0336 0.0729
Mycobacterium tuberculosis Probable oxidoreductase 0.0131 0.2279 0.2918
Chlamydia trachomatis oxoacyl-ACP synthase III 0.0348 0.6996 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0118 0.1992 0.2486
Schistosoma mansoni tyrosine kinase 0.0155 0.2792 0.2815
Brugia malayi flavodoxin family protein 0.0079 0.1137 0.1088
Plasmodium falciparum thioredoxin reductase 0.0052 0.0544 0.0646
Echinococcus granulosus dna polymerase eta 0.007 0.0945 0.0914
Leishmania major DNA polymerase eta, putative 0.0041 0.0309 0.0397
Echinococcus multilocularis chromobox protein 1 0.0076 0.1079 0.1052
Loa Loa (eye worm) hypothetical protein 0.0084 0.1246 0.1198
Leishmania major hypothetical protein, conserved 0.0079 0.1137 0.2599
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.0785 0.0674
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.0166 0.303 0.7705
Echinococcus granulosus epidermal growth factor receptor 0.0258 0.5033 0.5111
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0207 0.3918 0.3967
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0079 0.1137 0.1506
Leishmania major p450 reductase, putative 0.0207 0.3918 1
Onchocerca volvulus 0.0041 0.0311 0.0258
Brugia malayi GCC2 and GCC3 family protein 0.0041 0.0311 0.0258
Echinococcus multilocularis epidermal growth factor receptor 0.0258 0.5033 0.5111
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.0166 0.303 0.4331
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0072 0.0991 0.0962
Loa Loa (eye worm) TK/EPH protein kinase 0.0484 0.9956 0.9956
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0544 0.1267
Trypanosoma cruzi DNA polymerase kappa, putative 0.0042 0.0336 0.0729
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0072 0.0991 0.8515
Loa Loa (eye worm) glutathione reductase 0.0052 0.0544 0.0492
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0098 0.0044
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0207 0.3918 1
Schistosoma mansoni DNA helicase recq1 0.0031 0.0098 0.0051
Entamoeba histolytica type A flavoprotein, putative 0.0079 0.1137 1
Brugia malayi flavodoxin family protein 0.0207 0.3918 0.3884
Brugia malayi Thioredoxin reductase 0.0052 0.0544 0.0492
Echinococcus granulosus ephrin type A receptor 4 A 0.0422 0.8617 0.8792
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0072 0.0991 0.0942
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0079 0.1137 0.2801
Schistosoma mansoni hypothetical protein 0.0029 0.0054 0.0006
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0166 0.303 0.2992
Schistosoma mansoni chromobox protein 0.0076 0.1079 0.1057
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0207 0.3918 1
Trichomonas vaginalis DNA helicase recq, putative 0.0045 0.0397 0.0888
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.0166 0.303 0.3055
Echinococcus multilocularis dna polymerase eta 0.007 0.0945 0.0914
Echinococcus granulosus endonuclease reverse transcriptase 0.0041 0.0311 0.0263
Trypanosoma brucei Present in the outer mitochondrial membrane proteome 24 0.0029 0.0054 0.0012
Schistosoma mansoni tyrosine kinase 0.0155 0.2792 0.2815
Loa Loa (eye worm) FAD binding domain-containing protein 0.0207 0.3918 0.3884
Trypanosoma cruzi p450 reductase, putative 0.0207 0.3918 1
Treponema pallidum flavodoxin 0.0079 0.1137 0.5
Loa Loa (eye worm) flavodoxin family protein 0.0079 0.1137 0.1088
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0118 0.1992 0.2486
Schistosoma mansoni tyrosine kinase 0.0258 0.5033 0.5114
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0207 0.3918 1
Schistosoma mansoni phd finger protein 0.0029 0.0054 0.0006
Trichomonas vaginalis DNA helicase recq, putative 0.0034 0.016 0.0273
Echinococcus granulosus chromobox protein 1 0.0076 0.1079 0.1052
Entamoeba histolytica fatty acid elongase, putative 0.0045 0.0398 0.2442
Plasmodium vivax cysteine repeat modular protein 2, putative 0.0041 0.0311 0.0444
Trypanosoma cruzi DNA polymerase eta, putative 0.0041 0.0309 0.0659
Schistosoma mansoni hypothetical protein 0.0041 0.0311 0.0269
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Echinococcus granulosus methionine synthase reductase 0.0128 0.2195 0.2198
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0063 0.0785 0.0755
Entamoeba histolytica type A flavoprotein, putative 0.0079 0.1137 1
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0079 0.1137 0.2801
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0131 0.2279 0.2918
Trichomonas vaginalis DNA helicase recq1, putative 0.0045 0.0397 0.0888
Mycobacterium leprae 3-oxoacyl-[acyl-carrier-protein] synthase 1 KasA (BETA-KETOACYL-ACP SYNTHASE) (KAS I) 0.0141 0.2482 1
Echinococcus multilocularis epidermal growth factor receptor 0.0476 0.9794 1
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.0348 0.6996 1
Onchocerca volvulus 0.0041 0.0311 0.0258
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0079 0.1137 0.2801
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0169 0.3099 0.3126
Giardia lamblia Hypothetical protein 0.0183 0.3406 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0098 0.0000000010628
Schistosoma mansoni NADPH flavin oxidoreductase 0.0104 0.1683 0.1677
Echinococcus multilocularis chromobox protein 1 0.0076 0.1079 0.1052
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Entamoeba histolytica fatty acid elongase, putative 0.0045 0.0398 0.2442
Entamoeba histolytica fatty acid elongase, putative 0.0045 0.0398 0.2442
Schistosoma mansoni ephrin receptor 0.0381 0.772 0.7872
Echinococcus multilocularis bloom syndrome protein 0.0045 0.0397 0.0352
Schistosoma mansoni tyrosine kinase 0.0258 0.5033 0.5114
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0131 0.2279 0.2918
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0118 0.1992 0.2486
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III) 0.0348 0.6996 1
Plasmodium falciparum cysteine repeat modular protein 1 0.0041 0.0311 0.0308
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.0785 0.075
Loa Loa (eye worm) hypothetical protein 0.0043 0.0347 0.0294
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0079 0.1137 0.2801
Trichomonas vaginalis chromobox protein, putative 0.0076 0.1079 0.2652
Echinococcus multilocularis transcription factor Dp 1 0.0042 0.0327 0.028
Brugia malayi chromobox protein homolog 3 0.0043 0.0347 0.0294
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0128 0.2195 0.2202
Plasmodium vivax cysteine repeat modular protein 3, putative 0.0041 0.0311 0.0444
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0991 0.2425
Schistosoma mansoni sex comb on midleg homolog 0.0029 0.0054 0.0006
Plasmodium vivax flavodoxin domain containing protein 0.0183 0.3406 0.4868
Leishmania major DNA polymerase eta, putative 0.007 0.0945 0.209
Entamoeba histolytica deoxycytidyl transferase, putative 0.0042 0.0336 0.1806
Toxoplasma gondii flavodoxin domain-containing protein 0.0102 0.1649 0.5289
Toxoplasma gondii endonuclease IV APN 0.0084 0.1246 0.3915
Mycobacterium ulcerans endonuclease IV 0.0084 0.1246 0.1366
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0052 0.0544 0.0312
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0079 0.1137 0.2809
Brugia malayi ImpB/MucB/SamB family protein 0.007 0.0945 0.0895
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Loa Loa (eye worm) hypothetical protein 0.0041 0.0311 0.0258
Brugia malayi ImpB/MucB/SamB family protein 0.0042 0.0336 0.0283
Echinococcus multilocularis ephrin type A receptor 4 A 0.0422 0.8617 0.8792
Schistosoma mansoni hypothetical protein 0.0029 0.0054 0.0006
Plasmodium vivax beta-ketoacyl-acyl carrier protein synthase III precursor, putative 0.0348 0.6996 1
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0166 0.303 0.4045
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0544 0.0502
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0347 0.0758
Schistosoma mansoni tyrosine kinase 0.0476 0.9794 1
Loa Loa (eye worm) runx1 0.0061 0.0742 0.0691
Brugia malayi Bloom's syndrome protein homolog 0.0045 0.0397 0.0345
Plasmodium vivax apurinic/apyrimidinic endonuclease Apn1, putative 0.0084 0.1246 0.1781
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0063 0.0785 0.0734
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0031 0.0098 0.0044
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Echinococcus granulosus insulin receptor 0.0155 0.2792 0.2811
Schistosoma mansoni DNAj-like protein 0.0029 0.0054 0.0006
Leishmania major DNA polymerase kappa, putative 0.0042 0.0336 0.0469
Entamoeba histolytica hypothetical protein, conserved 0.0041 0.0311 0.1544
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0207 0.3918 1
Plasmodium falciparum cysteine repeat modular protein 4 0.0041 0.0311 0.0308
Plasmodium falciparum glutathione reductase 0.0052 0.0544 0.0646
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0072 0.0991 0.2213
Schistosoma mansoni spingomyelin synthetase-related 0.0029 0.0054 0.0006
Trypanosoma brucei DNA polymerase IV, putative 0.0042 0.0336 0.074
Schistosoma mansoni tyrosine kinase 0.0251 0.4884 0.4962
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0991 0.2434
Chlamydia trachomatis sulfite reductase 0.0128 0.2195 0.1651
Toxoplasma gondii hypothetical protein 0.0041 0.0311 0.0725
Echinococcus granulosus bloom syndrome protein 0.0045 0.0397 0.0352
Leishmania major calcium channel protein, putative,ion transporter, putative 0.004 0.0295 0.036
Loa Loa (eye worm) TK/EGFR protein kinase 0.0476 0.9794 0.9793
Brugia malayi Heterochromatin protein 1 0.0076 0.1079 0.103
Brugia malayi GCC2 and GCC3 family protein 0.0041 0.0311 0.0258
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0347 0.0758
Echinococcus multilocularis endonuclease reverse transcriptase 0.0041 0.0311 0.0263
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Brugia malayi GCC2 and GCC3 family protein 0.0041 0.0311 0.0258
Toxoplasma gondii GCC2 and GCC3 domain-containing protein 0.0041 0.0311 0.0725
Echinococcus multilocularis sodium channel protein 0.004 0.0295 0.0247
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0072 0.0991 0.0942
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.004 0.0295 0.0247
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0207 0.3918 1
Trichomonas vaginalis chromobox protein, putative 0.0076 0.1079 0.2652
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0131 0.2279 0.8359
Loa Loa (eye worm) hypothetical protein 0.003 0.0062 0.0008
Entamoeba histolytica type A flavoprotein, putative 0.0079 0.1137 1
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0207 0.3918 1
Entamoeba histolytica fatty acid elongase, putative 0.0045 0.0398 0.2442
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Entamoeba histolytica hypothetical protein 0.0041 0.0311 0.1544
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0207 0.3918 0.3967
Schistosoma mansoni lozenge 0.0061 0.0742 0.0711
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0031 0.0098 0.0045
Echinococcus granulosus transcription factor Dp 1 0.0042 0.0327 0.028
Toxoplasma gondii kringle domain-containing protein 0.0041 0.0311 0.0725
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0063 0.0785 0.0674
Brugia malayi Protein kinase domain containing protein 0.0155 0.2792 0.2753
Loa Loa (eye worm) hypothetical protein 0.0207 0.3918 0.3884
Plasmodium falciparum beta-ketoacyl-ACP synthase III 0.0348 0.6996 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.0347 0.0294
Schistosoma mansoni tyrosine kinase 0.0251 0.4884 0.4962
Schistosoma mansoni Protein aveugle 0.0029 0.0054 0.0006
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0042 0.0335 0.0344
Echinococcus granulosus epidermal growth factor receptor 0.0476 0.9794 1
Mycobacterium leprae 3-oxoacyl-[acyl-carrier-protein] synthase 2 KasB (BETA-KETOACYL-ACP SYNTHASE) (KAS I) 0.0141 0.2482 1
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0166 0.303 0.7702
Mycobacterium tuberculosis Probable dehydrogenase 0.0118 0.1992 0.2486
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.0166 0.303 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0072 0.0991 0.0967
Toxoplasma gondii thioredoxin reductase 0.0052 0.0544 0.1521
Brugia malayi Furin-like cysteine rich region family protein 0.0476 0.9794 0.9793
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0166 0.303 0.7702
Trypanosoma brucei trypanothione reductase 0.0052 0.0544 0.1277
Schistosoma mansoni polyhomeotic 0.0029 0.0054 0.0006
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.0348 0.6996 1
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.0166 0.303 0.3055
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0207 0.3918 0.5378
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0063 0.0785 0.1663
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0311 0.0444
Echinococcus multilocularis methionine synthase reductase 0.0128 0.2195 0.2198
Trypanosoma cruzi DNA polymerase eta, putative 0.007 0.0945 0.2305
Trypanosoma cruzi DNA polymerase kappa, putative 0.0042 0.0336 0.0729
Brugia malayi ephrin receptor 1 precursor 0.0183 0.3407 0.3371
Entamoeba histolytica protein kinase, putative 0.0041 0.0311 0.1544
Plasmodium falciparum nitric oxide synthase, putative 0.0207 0.3918 0.5537
Trypanosoma brucei DNA polymerase IV, putative 0.0042 0.0336 0.074
Loa Loa (eye worm) hypothetical protein 0.0031 0.0098 0.0044
Entamoeba histolytica type A flavoprotein, putative 0.0079 0.1137 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0042 0.0336 0.0295
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0258 0.5033 0.5111
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0072 0.0991 0.0962
Brugia malayi GCC2 and GCC3 family protein 0.0041 0.0311 0.0258
Echinococcus multilocularis insulin receptor 0.0155 0.2792 0.2811
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.0166 0.303 0.7638
Brugia malayi hypothetical protein 0.0133 0.2323 0.2281
Entamoeba histolytica hypothetical protein 0.0041 0.0311 0.1544
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0544 0.0502
Entamoeba histolytica cysteine-rich surface protein, putative 0.0041 0.0311 0.1544
Mycobacterium tuberculosis Probable reductase 0.0118 0.1992 0.2486
Plasmodium falciparum cysteine repeat modular protein 3 0.0041 0.0311 0.0308
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0169 0.3099 0.3126
Echinococcus multilocularis Protein lozenge 0.0061 0.0742 0.0706
Brugia malayi FAD binding domain containing protein 0.0128 0.2195 0.2152
Loa Loa (eye worm) heterochromatin protein 1 0.0076 0.1079 0.103
Plasmodium falciparum conserved protein, unknown function 0.0041 0.0311 0.0308
Brugia malayi DNA-(Apurinic or apyrimidinic site) lyase 0.0084 0.1246 0.1198
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0207 0.3918 0.3967
Loa Loa (eye worm) hypothetical protein 0.0041 0.0311 0.0258
Trypanosoma brucei unspecified product 0.0042 0.0336 0.074
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0075 0.0052
Onchocerca volvulus 0.0374 0.7571 0.7558
Giardia lamblia Sgs1 DNA helicase, putative 0.0031 0.0098 0.013
Giardia lamblia Hypothetical protein 0.0041 0.0311 0.0764
Plasmodium falciparum apurinic/apyrimidinic endonuclease Apn1, putative 0.0084 0.1246 0.1664
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0042 0.0336 0.0289
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0311 0.0444
Onchocerca volvulus 0.0486 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0042 0.0336 0.0729
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0079 0.1137 0.2801
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0031 0.0098 0.0045
Loa Loa (eye worm) hypothetical protein 0.019 0.3565 0.353
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0098 0.0044
Brugia malayi FAD binding domain containing protein 0.0207 0.3918 0.3884
Echinococcus granulosus sodium channel protein 0.004 0.0295 0.0247
Loa Loa (eye worm) hypothetical protein 0.0041 0.0311 0.0258
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0042 0.0336 0.0283
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0544 0.0492
Loa Loa (eye worm) hypothetical protein 0.007 0.0945 0.0895
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier protein] synthase 1 KasA (beta-ketoacyl-ACP synthase) (KAS I) 0.0141 0.2482 0.3223
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0079 0.1137 0.1506
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0046 0.0418 0.0366
Schistosoma mansoni lar interacting protein (lip)-related protein 0.0029 0.0054 0.0006
Entamoeba histolytica fatty acid elongase, putative 0.0045 0.0398 0.2442
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Echinococcus granulosus chromobox protein 1 0.0076 0.1079 0.1052
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0034 0.016 0.0284
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.0348 0.6996 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0042 0.0336 0.0295
Trypanosoma brucei DNA polymerase IV, putative 0.0042 0.0336 0.074
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0183 0.3406 0.8675
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.0785 0.075
Trypanosoma brucei SAM domain (Sterile alpha motif), putative 0.0029 0.0054 0.0012
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0207 0.3918 0.56
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0991 0.2425
Plasmodium vivax glutathione reductase, putative 0.0052 0.0544 0.0777
Loa Loa (eye worm) RecQ helicase 0.0045 0.0397 0.0345
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0075 0.0052
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0118 0.1992 0.6032
Schistosoma mansoni tyrosine kinase 0.0251 0.4884 0.4962
Loa Loa (eye worm) hypothetical protein 0.0034 0.0145 0.0092
Leishmania major cytochrome P450 reductase, putative 0.0183 0.3406 0.8637
Trichomonas vaginalis chromobox protein, putative 0.0046 0.0418 0.0941
Echinococcus granulosus dna polymerase kappa 0.0042 0.0336 0.0289
Schistosoma mansoni chromobox protein 0.0076 0.1079 0.1057
Echinococcus multilocularis 0.0146 0.2599 0.2612
Loa Loa (eye worm) hypothetical protein 0.0041 0.0311 0.0258
Loa Loa (eye worm) hypothetical protein 0.0348 0.6996 0.698
Schistosoma mansoni Protein aveugle 0.0029 0.0054 0.0006
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0118 0.1992 0.2486
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0059 0.0693 0.0642
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0042 0.0336 0.0289
Schistosoma mansoni DNA polymerase eta 0.007 0.0945 0.092
Plasmodium vivax hypothetical protein, conserved 0.0079 0.1137 0.1625
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.0166 0.303 0.3059
Brugia malayi glutathione reductase 0.0052 0.0544 0.0492
Mycobacterium ulcerans beta-ketoacyl synthase-like protein 0.0348 0.6996 1
Trichomonas vaginalis chromobox protein, putative 0.0046 0.0418 0.0941
Plasmodium vivax protein kinase, putative 0.0036 0.0203 0.029
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.0166 0.303 0.2992
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0041 0.0311 0.0444
Loa Loa (eye worm) TK/INSR protein kinase 0.0155 0.2792 0.2753
Loa Loa (eye worm) FAD binding domain-containing protein 0.0128 0.2195 0.2152
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0166 0.303 0.4045
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0207 0.3918 0.3967
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.0166 0.303 0.4251
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0207 0.3918 1
Giardia lamblia CEGP1 protein 0.0041 0.0311 0.0764
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0041 0.0309 0.0719
Schistosoma mansoni lip-related protein (liprin) alpha 0.0029 0.0054 0.0006
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0031 0.0098 0.0045
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0031 0.0098 0.0045
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0042 0.0336 0.0729
Plasmodium falciparum cysteine repeat modular protein 2 0.0041 0.0311 0.0308
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Loa Loa (eye worm) hypothetical protein 0.0374 0.7571 0.7558
Trichomonas vaginalis sulfite reductase, putative 0.0207 0.3918 1
Entamoeba histolytica type A flavoprotein, putative 0.0079 0.1137 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0336 0.074
Mycobacterium tuberculosis Probable endonuclease IV End (endodeoxyribonuclease IV) (apurinase) 0.0084 0.1246 0.1366
Schistosoma mansoni DNA helicase recq5 0.0031 0.0098 0.0051
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0079 0.1137 0.2801
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.0785 0.0674
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.0166 0.303 0.3103
Onchocerca volvulus 0.0034 0.0145 0.0092
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0207 0.3918 1
Giardia lamblia Nitric oxide synthase, inducible 0.0183 0.3406 1
Leishmania major trypanothione reductase 0.0052 0.0544 0.1022
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0034 0.016 0.0273
Giardia lamblia DINP protein human, muc B family 0.0042 0.0336 0.0841
Schistosoma mansoni sex comb on midleg homolog 0.0029 0.0054 0.0006

Activities

Activity type Activity value Assay description Source Reference
Injected dose (functional) = 0.95 % Myocardial levels of tracer copper in rats 2 hr after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 1.5 % Myocardial levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 1.7 % Myocardial levels of tracer copper in rats 1 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) = 2.4 % Kidney levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 2.5 % Kidney levels of tracer copper in rats 1 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 2.6 % Brain levels of tracer copper in rats 2 hr after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 2.9 % Brain levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 3.1 % Kidney levels of tracer copper in rats 2 hr after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 3.4 % Brain levels of tracer copper in rats 1 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 3.4 % Pulmonary levels of tracer copper in rats 1 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 3.8 % Pulmonary levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 7.1 % Blood levels of tracer copper in rats 1 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 7.7 % Blood levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 8.3 % Blood levels of tracer copper in rats 2 hr after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 17.2 % Liver levels of tracer copper in rats 1 min after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 19.2 % Liver levels of tracer copper in rats 2 hr after injection into the femoral vein ChEMBL. 2342070
Injected dose (functional) = 25.9 % Liver levels of tracer copper in rats 5 min after injection into the femoral vein ChEMBL. 2342070
logP (ADMET) = 2.77 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.
 
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

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.