Detailed information for compound 1368071

Basic information

Technical information
  • TDR Targets ID: 1368071
  • Name: N-(3,4-dimethylphenyl)-N-[2-oxo-2-(oxolan-2-y lmethylamino)ethyl]-N'-(1,3-thiazol-2-yl)buta nediamide
  • MW: 444.547 | Formula: C22H28N4O4S
  • H donors: 2 H acceptors: 4 LogP: 1.87 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CN(c1ccc(c(c1)C)C)C(=O)CCC(=O)Nc1nccs1)NCC1CCCO1
  • InChi: 1S/C22H28N4O4S/c1-15-5-6-17(12-16(15)2)26(14-20(28)24-13-18-4-3-10-30-18)21(29)8-7-19(27)25-22-23-9-11-31-22/h5-6,9,11-12,18H,3-4,7-8,10,13-14H2,1-2H3,(H,24,28)(H,23,25,27)
  • InChiKey: GDAFHHKNNVGNRN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(3,4-dimethylphenyl)-N-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]-N'-thiazol-2-yl-butanediamide
  • N-(3,4-dimethylphenyl)-N-[2-oxo-2-(2-tetrahydrofuranylmethylamino)ethyl]-N'-(2-thiazolyl)butanediamide
  • N-(3,4-dimethylphenyl)-N-[2-keto-2-(tetrahydrofurfurylamino)ethyl]-N'-thiazol-2-yl-succinamide
  • ASN 05396382

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
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0258 0.1562 0.3258
Schistosoma mansoni hypothetical protein 0.03 0.1923 0.1867
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Leishmania major phosphatidylcholine:ceramide cholinephosphotransferase 2 0.0457 0.3263 1
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Schistosoma mansoni multidrug resistance protein 0.0106 0.027 0.0203
Schistosoma mansoni hypothetical protein 0.0246 0.1467 0.1408
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0236 0.138 0.4676
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0236 0.138 0.4676
Echinococcus granulosus adam 0.013 0.0472 0.0566
Brugia malayi MH2 domain containing protein 0.0587 0.437 0.9117
Schistosoma mansoni multidrug resistance protein 0.0106 0.027 0.0203
Brugia malayi Matrixin family protein 0.024 0.1416 0.2954
Echinococcus multilocularis cysteine protease 0.0111 0.0309 0.0322
Onchocerca volvulus 0.0246 0.1467 0.2892
Brugia malayi cathepsin Z-like cysteine proteinase 0.0236 0.138 0.288
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Onchocerca volvulus 0.0111 0.0309 0.0418
Plasmodium falciparum cysteine proteinase falcipain 3 0.0111 0.0309 0.1168
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0086 0.0094 0.0026
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0236 0.138 0.4676
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0174 0.0851 0.1015
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0111 0.0309 0.0645
Loa Loa (eye worm) hypothetical protein 0.0164 0.076 0.1586
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0164 0.076 0.0697
Plasmodium vivax aspartyl protease, putative 0.0122 0.0404 0.1526
Schistosoma mansoni cathepsin D (A01 family) 0.1246 1 1
Mycobacterium leprae PROBABLE HYDROLASE 0.0258 0.1562 0.5
Echinococcus granulosus Dipeptidyl peptidase 9 0.0285 0.1798 0.2547
Toxoplasma gondii 1,3-beta-glucan synthase component protein 0.1056 0.838 1
Onchocerca volvulus 0.0106 0.027 0.0334
Entamoeba histolytica cysteine protease, putative 0.0111 0.0309 0.0059
Onchocerca volvulus 0.03 0.1923 0.3866
Brugia malayi Angiotensin-converting enzyme family protein 0.0618 0.4639 0.9678
Echinococcus granulosus caspase 0.0392 0.2709 0.3908
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Plasmodium vivax aspartyl protease, putative 0.0286 0.1804 0.6819
Brugia malayi hypothetical protein 0.0122 0.0404 0.0842
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0384 0.2645 0.3813
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0093 0.016 0.0098
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Brugia malayi Trypsin family protein 0.0157 0.0704 0.1469
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Loa Loa (eye worm) hypothetical protein 0.0246 0.1467 0.3061
Loa Loa (eye worm) hypothetical protein 0.024 0.1416 0.2954
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Brugia malayi Pepsin A precursor 0.0122 0.0404 0.0842
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0105 0.026 0.0248
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0106 0.027 0.0322
Plasmodium falciparum metacaspase-like protein 0.0247 0.1472 0.5563
Echinococcus granulosus Blood coagulation inhibitor Disintegrin 0.019 0.0984 0.1331
Echinococcus granulosus geminin 0.0169 0.0807 0.1066
Loa Loa (eye worm) hypothetical protein 0.0122 0.0404 0.0842
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0289 0.1829 0.2594
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0285 0.1798 0.551
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0247 0.1472 0.1756
Plasmodium falciparum plasmepsin VI 0.0384 0.2645 1
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0285 0.1798 0.551
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0384 0.2645 0.5519
Echinococcus multilocularis cysteine protease 0.0111 0.0309 0.0322
Plasmodium falciparum plasmepsin II 0.0384 0.2645 1
Echinococcus granulosus caspase 3 0.0145 0.0601 0.0758
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0312 0.2028 0.1974
Loa Loa (eye worm) hypothetical protein 0.0122 0.0404 0.0842
Trypanosoma brucei metacaspase MCA2 0.0247 0.1472 0.4509
Loa Loa (eye worm) hypothetical protein 0.0106 0.027 0.0562
Plasmodium falciparum plasmepsin III 0.0122 0.0404 0.1526
Onchocerca volvulus 0.0111 0.0309 0.0418
Loa Loa (eye worm) hypothetical protein 0.0157 0.0704 0.1469
Trypanosoma brucei sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0457 0.3263 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0111 0.0309 0.0166
Loa Loa (eye worm) fibroinase 0.0111 0.0309 0.0645
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0106 0.027 0.0263
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Plasmodium vivax aspartyl protease, putative 0.0286 0.1804 0.6819
Onchocerca volvulus Cathepsin L homolog 0.0111 0.0309 0.0418
Trypanosoma cruzi cysteine peptidase, putative 0.0111 0.0309 0.0947
Schistosoma mansoni subfamily C14A unassigned peptidase (C14 family) 0.0247 0.1472 0.1413
Loa Loa (eye worm) hypothetical protein 0.0105 0.026 0.0542
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0285 0.1798 0.2547
Trypanosoma cruzi cysteine peptidase, putative 0.0111 0.0309 0.0947
Trypanosoma cruzi metacaspase, putative 0.0247 0.1472 0.4509
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Trypanosoma cruzi metacaspase, putative 0.0247 0.1472 0.4509
Toxoplasma gondii aspartyl protease 0.0122 0.0404 0.0482
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.0103 0.0242 0.0915
Brugia malayi cathepsin Z-like cysteine proteinase 0.0236 0.138 0.288
Trypanosoma cruzi sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0457 0.3263 1
Brugia malayi Eukaryotic aspartyl protease family protein 0.0122 0.0404 0.0842
Trypanosoma brucei Metacaspase-4 0.0247 0.1472 0.4509
Brugia malayi ABC transporter family protein 0.0106 0.027 0.0562
Echinococcus multilocularis multidrug resistance protein 1 0.0106 0.027 0.0263
Echinococcus granulosus multidrug resistance protein 1 0.0106 0.027 0.0263
Brugia malayi Hemopexin family protein 0.03 0.1923 0.4011
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0809 0.6271 0.9231
Echinococcus multilocularis ATP binding cassette sub family B 0.0105 0.026 0.0248
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Brugia malayi prolyl oligopeptidase family protein 0.0285 0.1798 0.3751
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0111 0.0309 0.0322
Loa Loa (eye worm) cysteine protease 0.0111 0.0309 0.0645
Echinococcus granulosus GPCR family 2 0.0093 0.016 0.0098
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0236 0.138 0.4676
Loa Loa (eye worm) prolyl oligopeptidase 0.0289 0.1829 0.3816
Echinococcus granulosus cathepsin L cysteine proteinase 0.0111 0.0309 0.0322
Toxoplasma gondii PAN domain-containing protein 0.0602 0.4505 0.5377
Loa Loa (eye worm) aspartyl protease 6 0.0122 0.0404 0.0842
Echinococcus granulosus disintegrin and metalloproteinase 0.0121 0.0396 0.0451
Loa Loa (eye worm) hypothetical protein 0.0152 0.0662 0.138
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0285 0.1798 0.551
Trypanosoma cruzi cysteine peptidase, putative 0.0111 0.0309 0.0947
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0285 0.1798 0.551
Schistosoma mansoni hypothetical protein 0.0169 0.0807 0.0744
Schistosoma mansoni hypothetical protein 0.0093 0.016 0.0092
Loa Loa (eye worm) hypothetical protein 0.0384 0.2645 0.5519
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Onchocerca volvulus Matrilysin homolog 0.024 0.1416 0.2783
Echinococcus granulosus caspase 2 0.0636 0.4793 0.7023
Plasmodium vivax metacaspase 1, putative 0.0247 0.1472 0.5563
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Schistosoma mansoni hypothetical protein 0.0201 0.1083 0.1022
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0106 0.027 0.0263
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0106 0.027 0.0263
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0295 0.1879 0.392
Loa Loa (eye worm) hypothetical protein 0.0636 0.4793 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0164 0.076 0.0697
Brugia malayi Disintegrin family protein 0.0121 0.0396 0.0825
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0093 0.016 0.0333
Echinococcus granulosus multidrug resistance protein 1 0.0106 0.027 0.0263
Echinococcus multilocularis caspase 3 0.0145 0.0601 0.0758
Echinococcus multilocularis cathepsin b 0.0164 0.076 0.0996
Loa Loa (eye worm) ctsf protein 0.0111 0.0309 0.0645
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Schistosoma mansoni cathepsin F (C01 family) 0.0111 0.0309 0.0242
Echinococcus granulosus caspase 8 0.0247 0.1472 0.2059
Plasmodium vivax multidrug resistance protein 1, putative 0.0106 0.027 0.1019
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0236 0.138 0.288
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0289 0.1829 0.2594
Brugia malayi metalloprotease disintegrin 16 with thrombospondin type I motif 0.0087 0.0105 0.022
Onchocerca volvulus Matrilysin homolog 0.057 0.4227 0.8789
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0295 0.1879 0.392
Onchocerca volvulus 0.024 0.1416 0.2783
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.0221 0.1249 0.472
Brugia malayi cathepsin B-like cysteine proteinase 0.0164 0.076 0.1586
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Echinococcus multilocularis caspase 2 0.0636 0.4793 0.7023
Echinococcus multilocularis caspase 0.0392 0.2709 0.3908
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Schistosoma mansoni caspase-7 (C14 family) 0.0392 0.2709 0.2659
Schistosoma mansoni caspase-7 (C14 family) 0.0636 0.4793 0.4758
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Loa Loa (eye worm) hypothetical protein 0.0258 0.1562 0.3258
Trypanosoma cruzi cysteine peptidase, putative 0.0111 0.0309 0.0947
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Echinococcus multilocularis caspase 8 0.0247 0.1472 0.2059
Loa Loa (eye worm) hypothetical protein 0.0295 0.1879 0.392
Echinococcus granulosus cathepsin b 0.0164 0.076 0.0996
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0106 0.027 0.0263
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0384 0.2645 0.3157
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Onchocerca volvulus 0.0111 0.0309 0.0418
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.0221 0.1249 0.472
Brugia malayi Matrixin family protein 0.0612 0.4587 0.957
Toxoplasma gondii preprocathepsin c precursor, putative 0.0221 0.1249 0.149
Echinococcus multilocularis a disintegrin and metalloproteinase with 0.0087 0.0105 0.0017
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0289 0.1829 0.3667
Echinococcus granulosus apoptotic protease activating factor 1 0.0246 0.1467 0.2052
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0122 0.0404 0.0482
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0111 0.0309 0.0645
Toxoplasma gondii aspartyl protease ASP3 0.0286 0.1804 0.2153
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0164 0.076 0.2329
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Trypanosoma cruzi metacaspase, putative 0.0247 0.1472 0.4509
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0093 0.016 0.0098
Echinococcus granulosus cathepsin l1 0.0111 0.0309 0.0322
Onchocerca volvulus 0.0111 0.0309 0.0418
Trypanosoma cruzi metacaspase 5, putative 0.0247 0.1472 0.4509
Brugia malayi Matrixin family protein 0.024 0.1416 0.2954
Plasmodium vivax vivapain-2 0.0111 0.0309 0.1168
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0093 0.016 0.0098
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0285 0.1798 0.551
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Plasmodium vivax vivapain-2 0.0111 0.0309 0.1168
Echinococcus granulosus cathepsin b 0.0164 0.076 0.0996
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0384 0.2645 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0111 0.0309 0.0322
Schistosoma mansoni hypothetical protein 0.0169 0.0807 0.0744
Onchocerca volvulus Cell death protein 3 homolog 0.0636 0.4793 1
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0247 0.1472 0.1756
Loa Loa (eye worm) transcription factor SMAD2 0.0587 0.437 0.9117
Mycobacterium ulcerans hydrolase 0.0258 0.1562 0.5
Plasmodium falciparum plasmepsin VIII, putative 0.0122 0.0404 0.1526
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Toxoplasma gondii cathepsin CPL 0.0111 0.0309 0.0369
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Onchocerca volvulus 0.0111 0.0309 0.0418
Brugia malayi latrophilin 2 splice variant baaae 0.0201 0.1083 0.2259
Echinococcus multilocularis geminin 0.0169 0.0807 0.1066
Onchocerca volvulus 0.0111 0.0309 0.0418
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0106 0.027 0.0263
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase 0.0392 0.2709 0.3908
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Echinococcus multilocularis adam 17 protease 0.0184 0.0934 0.1256
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Plasmodium falciparum metacaspase 1 0.0247 0.1472 0.5563
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0106 0.027 0.0263
Plasmodium falciparum plasmepsin IV 0.0384 0.2645 1
Loa Loa (eye worm) hypothetical protein 0.0157 0.0704 0.1469
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0289 0.1829 0.1773
Onchocerca volvulus 0.0157 0.0704 0.1262
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0247 0.1472 0.1756
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.0221 0.1249 0.1188
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Loa Loa (eye worm) matrix metalloproteinase 0.024 0.1416 0.2954
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Entamoeba histolytica hypothetical protein, conserved 0.089 0.6962 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.087 0.6786 1
Toxoplasma gondii aspartyl protease ASP1 0.0384 0.2645 0.3157
Plasmodium vivax aspartyl proteinase, putative 0.0384 0.2645 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0111 0.0309 0.0322
Trypanosoma brucei metacaspase 5, putative 0.0247 0.1472 0.4509
Loa Loa (eye worm) hypothetical protein 0.0461 0.3299 0.6883
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Trypanosoma cruzi metacaspase, putative 0.0247 0.1472 0.4509
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0157 0.0704 0.064
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Loa Loa (eye worm) MH2 domain-containing protein 0.0587 0.437 0.9117
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Loa Loa (eye worm) matrixin family protein 0.0612 0.4587 0.957
Brugia malayi hypothetical protein 0.0122 0.0404 0.0842
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0106 0.027 0.0263
Brugia malayi mucosa associated lymphoid tissue lymphoma translocation protein 1 0.0247 0.1472 0.307
Echinococcus multilocularis disintegrin and metalloproteinase 0.0121 0.0396 0.0451
Giardia lamblia Cathepsin B precursor 0.0236 0.138 1
Entamoeba histolytica cysteine proteinase, putative 0.0111 0.0309 0.0059
Brugia malayi hypothetical protein 0.0133 0.05 0.1044
Onchocerca volvulus Matrix metalloproteinase homolog 0.0498 0.3614 0.748
Brugia malayi aspartic protease BmAsp-1, identical 0.0122 0.0404 0.0842
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0106 0.027 0.0263
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0111 0.0309 0.1168
Trypanosoma brucei metacaspase MCA3 0.0247 0.1472 0.4509
Trypanosoma brucei sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0457 0.3263 1
Plasmodium falciparum plasmepsin X 0.0286 0.1804 0.6819
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0164 0.076 0.0697
Schistosoma mansoni cathepsin F (C01 family) 0.0111 0.0309 0.0242
Trypanosoma cruzi cruzipain precursor, putative 0.0111 0.0309 0.0947
Brugia malayi Calcitonin receptor-like protein seb-1 0.0295 0.1879 0.392
Loa Loa (eye worm) multidrug resistance protein 3 0.0106 0.027 0.0562
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Brugia malayi Cathepsin L-like precursor 0.0111 0.0309 0.0645
Plasmodium falciparum plasmepsin V 0.0122 0.0404 0.1526
Toxoplasma gondii PAN domain-containing protein 0.0602 0.4505 0.5377
Brugia malayi hypothetical protein 0.013 0.0472 0.0985
Loa Loa (eye worm) hypothetical protein 0.0312 0.2028 0.4232
Loa Loa (eye worm) hypothetical protein 0.0111 0.0309 0.0645
Echinococcus granulosus a disintegrin and metalloproteinase with 0.0087 0.0105 0.0017
Leishmania major p-glycoprotein 0.0106 0.027 0.0826
Echinococcus multilocularis Blood coagulation inhibitor, Disintegrin 0.019 0.0984 0.1331
Schistosoma mansoni hypothetical protein 0.0093 0.016 0.0092
Loa Loa (eye worm) hypothetical protein 0.0133 0.05 0.1044
Echinococcus multilocularis adam 0.013 0.0472 0.0566
Plasmodium vivax plasmepsin V, putative 0.0122 0.0404 0.1526
Echinococcus multilocularis apoptotic protease activating factor 1 0.0246 0.1467 0.2052
Loa Loa (eye worm) hypothetical protein 0.0201 0.1083 0.2259
Trypanosoma brucei metacaspase 0.0247 0.1472 0.4509
Loa Loa (eye worm) hypothetical protein 0.0093 0.016 0.0333
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0106 0.027 0.0263
Schistosoma mansoni hypothetical protein 0.0093 0.016 0.0092
Brugia malayi aspartic protease BmAsp-2, identical 0.0122 0.0404 0.0842
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Trypanosoma cruzi sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0457 0.3263 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Schistosoma mansoni smdr2 0.0106 0.027 0.0203
Schistosoma mansoni caspase-3 (C14 family) 0.0392 0.2709 0.2659
Onchocerca volvulus 0.0111 0.0309 0.0418
Loa Loa (eye worm) hypothetical protein 0.0106 0.027 0.0562
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Onchocerca volvulus Cathepsin F homolog 0.0111 0.0309 0.0418
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Schistosoma mansoni adam (A disintegrin and metalloprotease 0.013 0.0472 0.0407
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Plasmodium falciparum plasmepsin VII 0.0122 0.0404 0.1526
Brugia malayi Latrophilin receptor protein 2 0.0093 0.016 0.0333
Leishmania major cysteine peptidase A (CPA) 0.0111 0.0309 0.0947
Plasmodium falciparum plasmepsin IX 0.0286 0.1804 0.6819
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0122 0.0404 0.0842
Echinococcus granulosus cathepsin l cysteine peptidase 0.0111 0.0309 0.0322
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0086 0.0094 0.0026
Trichomonas vaginalis conserved hypothetical protein 0.0247 0.1472 0.5059
Echinococcus granulosus multidrug resistance protein 1 0.0106 0.027 0.0263
Loa Loa (eye worm) hypothetical protein 0.024 0.1416 0.2954
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0384 0.2645 0.2595
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Leishmania major cathepsin L-like protease 0.0111 0.0309 0.0947
Plasmodium vivax plasmepsin IV, putative 0.0384 0.2645 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0111 0.0309 0.0322
Entamoeba histolytica cysteine proteinase, putative 0.0111 0.0309 0.0059
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Onchocerca volvulus 0.0122 0.0404 0.062
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.087 0.6786 1
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.0103 0.0242 0.0915
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0106 0.027 0.0562
Schistosoma mansoni multidrug resistance protein 0.0106 0.027 0.0203
Toxoplasma gondii cathepsin CPC1 0.0221 0.1249 0.149
Echinococcus multilocularis multidrug resistance protein 1 0.0106 0.027 0.0263
Plasmodium falciparum multidrug resistance protein 1 0.0106 0.027 0.1019
Plasmodium vivax hypothetical protein, conserved 0.0247 0.1472 0.5563
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0111 0.0309 0.0166
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase 0.0392 0.2709 0.3908
Loa Loa (eye worm) reprolysin 0.0086 0.0094 0.0196
Loa Loa (eye worm) hypothetical protein 0.0086 0.0094 0.0196
Brugia malayi Matrixin family protein 0.024 0.1416 0.2954
Schistosoma mansoni ADAMTS5 peptidase (M12 family) 0.0087 0.0105 0.0037
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0221 0.1249 0.8843
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0258 0.1562 1
Toxoplasma gondii cathepsin CPC2 0.0103 0.0242 0.0289
Schistosoma mansoni hypothetical protein 0.0093 0.016 0.0092
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0106 0.027 0.0322
Brugia malayi prolyl oligopeptidase family protein 0.0289 0.1829 0.3816
Plasmodium vivax aspartyl proteinase, putative 0.0122 0.0404 0.1526
Leishmania major metacaspase, putative 0.0247 0.1472 0.4509
Brugia malayi Cell death protein 3 precursor 0.0636 0.4793 1
Echinococcus multilocularis GPCR, family 2 0.0093 0.016 0.0098
Loa Loa (eye worm) matrixin family protein 0.0498 0.3614 0.7539
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0111 0.0309 0.1168
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Brugia malayi hypothetical protein 0.0246 0.1467 0.3061
Plasmodium falciparum plasmepsin I 0.0384 0.2645 1
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0384 0.2645 0.3813
Trypanosoma cruzi metacaspase 5, putative 0.0247 0.1472 0.4509
Loa Loa (eye worm) latrophilin receptor protein 2 0.0093 0.016 0.0333
Brugia malayi multidrug resistance protein 3 0.0106 0.027 0.0562
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Schistosoma mansoni memapsin-2 (A01 family) 0.0535 0.3927 0.3885
Brugia malayi Papain family cysteine protease containing protein 0.0111 0.0309 0.0645
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.0221 0.1249 0.472
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0106 0.027 0.0826
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0111 0.0309 0.0947
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0122 0.0404 0.0338
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0164 0.076 0.0697
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0111 0.0309 0.0166
Brugia malayi Matrixin family protein 0.024 0.1416 0.2954
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0106 0.027 0.5
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.0618 0.4639 0.9678
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0285 0.1798 0.1742
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0247 0.1472 0.5059
Schistosoma mansoni dihydroceramide desaturase 0.0121 0.0396 0.033
Echinococcus granulosus adam 17 protease 0.0244 0.1443 0.2017
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Echinococcus multilocularis cathepsin b 0.0164 0.076 0.0996
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.0221 0.1249 0.472
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0111 0.0309 0.0166
Schistosoma mansoni ADAM17 peptidase (M12 family) 0.0184 0.0934 0.0872
Loa Loa (eye worm) hypothetical protein 0.0247 0.1472 0.307
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0093 0.016 0.0098
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0157 0.0704 0.064
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0149 0.0633 0.1531
Onchocerca volvulus 0.0122 0.0404 0.062
Onchocerca volvulus Cathepsin L homolog 0.0111 0.0309 0.0418

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Bibliographic References

No literature references available for this target.

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