Detailed information for compound 447823

Basic information

Technical information
  • TDR Targets ID: 447823
  • Name: 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)prop anoyl]amino]-4-oxobutanoyl]amino]-5-[(1-hydro xy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxopent anoic acid
  • MW: 594.616 | Formula: C29H34N6O8
  • H donors: 8 H acceptors: 8 LogP: -2.48 Rotable bonds: 19
    Rule of 5 violations (Lipinski): 3
  • SMILES: NC(=O)CC(C(=O)NC(C(=O)NC(C(=O)O)Cc1ccccc1)CCC(=O)O)NC(=O)C(Cc1c[nH]c2c1cccc2)N
  • InChi: 1S/C29H34N6O8/c30-19(13-17-15-32-20-9-5-4-8-18(17)20)26(39)34-22(14-24(31)36)28(41)33-21(10-11-25(37)38)27(40)35-23(29(42)43)12-16-6-2-1-3-7-16/h1-9,15,19,21-23,32H,10-14,30H2,(H2,31,36)(H,33,41)(H,34,39)(H,35,40)(H,37,38)(H,42,43)
  • InChiKey: ZZFMSLPQUYJBOI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxo-butanoyl]amino]-5-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-5-oxo-pentanoic acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1,4-dioxobutyl]amino]-5-[(1-benzyl-2-hydroxy-2-oxoethyl)amino]-5-oxopentanoic acid
  • 4-[[4-azanyl-2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-4-oxo-butanoyl]amino]-5-[(1-hydroxy-1-oxo-3-phenyl-propan-2-yl)amino]-5-oxo-pentanoic acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-keto-butanoyl]amino]-5-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-5-keto-valeric acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxo-butanoyl]amino]-5-[[2-hydroxy-2-oxo-1-(phenylmethyl)ethyl]amino]-5-oxo-pentanoic acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1,4-dioxobutyl]amino]-5-[[2-hydroxy-2-oxo-1-(phenylmethyl)ethyl]amino]-5-oxopentanoic acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-keto-butanoyl]amino]-5-[[1-(benzyl)-2-hydroxy-2-keto-ethyl]amino]-5-keto-valeric acid
  • 4-[[4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxo-butanoyl]amino]-5-[(1-hydroxy-1-oxo-3-phenyl-propan-2-yl)amino]-5-oxo-pentanoic acid

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
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.0019 0.003 0.1398
Trichomonas vaginalis neuroendocrine convertase 2 precursor, putative 0.0085 0.0676 0.2667
Mycobacterium ulcerans oxidoreductase 0.0028 0.0124 0.6156
Echinococcus granulosus lysine specific histone demethylase 1A 0.0028 0.0124 0.0113
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0865 0.8297 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0139 0.1208 0.1447
Loa Loa (eye worm) endoprotease bli-4 0.0439 0.4133 0.4116
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.0083 0.4065
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0081 0.0641 0.075
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0024 0.0083 0.3628
Echinococcus multilocularis 0.0354 0.3304 0.396
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0124 0.1528
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0024 0.0083 0.0052
Schistosoma mansoni hypothetical protein 0.0039 0.0226 0.024
Echinococcus multilocularis neuroendocrine convertase 2 0.0276 0.2541 0.3037
Plasmodium falciparum plasmepsin I 0.0081 0.0641 1
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0056 0.0396 0.0366
Echinococcus multilocularis integrin alpha 3 0.0138 0.1198 0.1413
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Loa Loa (eye worm) hypothetical protein 0.0028 0.0124 0.0094
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.0019 0.003 0.0766
Plasmodium vivax plasmepsin V, putative 0.0045 0.0287 0.4198
Brugia malayi celfurPC protein 0.0354 0.3304 0.3284
Loa Loa (eye worm) hypothetical protein 0.0151 0.1323 0.1297
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0019 0.0037 0.172
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0081 0.0641 0.0739
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0054 0.0377 0.0426
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0045 0.0287 0.0257
Loa Loa (eye worm) hypothetical protein 0.0081 0.0641 0.0613
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0104 0.086 0.1018
Onchocerca volvulus 0.0042 0.0257 0.1493
Plasmodium vivax aspartyl proteinase, putative 0.0081 0.0641 1
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0028 0.0124 0.1528
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0024 0.0083 0.3628
Schistosoma mansoni hypothetical protein 0.0081 0.0635 0.0743
Mycobacterium ulcerans polyketide synthase 0.0024 0.0083 0.4065
Brugia malayi latrophilin 2 splice variant baaae 0.0174 0.155 0.1524
Echinococcus granulosus lysine specific histone demethylase 1A 0.0139 0.1208 0.1425
Toxoplasma gondii type I fatty acid synthase, putative 0.0017 0.0015 0.0232
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0024 0.0083 0.4065
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0028 0.0124 0.6156
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0865 0.8297 1
Loa Loa (eye worm) hypothetical protein 0.0174 0.1549 0.1523
Echinococcus multilocularis Furin 1 0.0104 0.086 0.1003
Echinococcus granulosus GPCR family 2 0.0081 0.0635 0.0732
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0081 0.0641 1
Brugia malayi aspartic protease BmAsp-1, identical 0.0045 0.0287 0.0257
Schistosoma mansoni integrin alpha-ps 0.0081 0.0637 0.0745
Schistosoma mansoni hypothetical protein 0.0054 0.0377 0.0426
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.0097 0.481
Brugia malayi SWIRM domain containing protein 0.0151 0.1323 0.1297
Loa Loa (eye worm) hypothetical protein 0.0439 0.4133 0.4116
Brugia malayi Integrin alpha pat-2 precursor 0.018 0.161 0.1584
Loa Loa (eye worm) hypothetical protein 0.0081 0.0635 0.0607
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0028 0.0124 0.193
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0028 0.0124 0.6156
Loa Loa (eye worm) apoptosis regulator protein 0.0054 0.0377 0.0348
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0028 0.0124 0.1528
Schistosoma mansoni hypothetical protein 0.0085 0.0676 0.0793
Loa Loa (eye worm) hypothetical protein 0.1039 1 1
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0026 0.0097 0.481
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Loa Loa (eye worm) hypothetical protein 0.0139 0.1208 0.1181
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.0097 0.4429
Loa Loa (eye worm) hypothetical protein 0.0142 0.1231 0.1204
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0267 0.2452 1
Loa Loa (eye worm) hypothetical protein 0.0045 0.0287 0.0257
Toxoplasma gondii subtilisin SUB1 0.0019 0.003 0.0474
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0081 0.0635 0.0732
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.0019 0.003 0.1398
Plasmodium falciparum plasmepsin IV 0.0081 0.0641 1
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0028 0.0124 0.0115
Loa Loa (eye worm) fatty acid synthase 0.0024 0.008 0.0049
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0019 0.0037 0.172
Plasmodium vivax aspartyl protease, putative 0.0045 0.0287 0.4198
Brugia malayi hypothetical protein 0.0045 0.0287 0.0257
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.002 0.0043 0.2064
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0026 0.0097 0.481
Onchocerca volvulus 0.0045 0.0287 0.1689
Loa Loa (eye worm) latrophilin receptor protein 2 0.0081 0.0635 0.0607
Leishmania major UDP-galactopyranose mutase 0.0028 0.0124 1
Mycobacterium ulcerans thioesterase TesA 0.002 0.0043 0.2064
Trypanosoma cruzi UDP-galactopyranose mutase 0.0028 0.0124 1
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.0019 0.003 0.0766
Toxoplasma gondii subtilisin SUB4 0.0019 0.003 0.0474
Schistosoma mansoni hypothetical protein 0.0081 0.0635 0.0743
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0026 0.0097 0.481
Echinococcus granulosus furin 0.0439 0.4133 0.4963
Brugia malayi Myb-like DNA-binding domain containing protein 0.0169 0.15 0.1475
Brugia malayi Calcitonin receptor-like protein seb-1 0.0255 0.2338 0.2315
Plasmodium vivax aspartyl protease, putative 0.0045 0.0287 0.4198
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0036 0.0199 1
Mycobacterium ulcerans thioesterase 0.002 0.0043 0.2064
Schistosoma mansoni integrin alpha-ps 0.0042 0.0259 0.028
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0023 0.0076 0.3234
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0028 0.0124 0.6156
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0081 0.0641 0.2522
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.0019 0.003 0.1398
Loa Loa (eye worm) hypothetical protein 0.0169 0.15 0.1475
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Plasmodium falciparum plasmepsin IX 0.0045 0.0287 0.4198
Mycobacterium ulcerans polyketide synthase 0.0026 0.0097 0.481
Toxoplasma gondii subtilisin SUB9 0.0019 0.003 0.0474
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0028 0.0124 0.6156
Echinococcus multilocularis integrin beta 2 0.0274 0.2521 0.3013
Loa Loa (eye worm) proprotein convertase 2 0.0104 0.086 0.0832
Echinococcus multilocularis integrin alpha ps 0.0039 0.0226 0.0236
Toxoplasma gondii aspartyl protease 0.0045 0.0287 0.4473
Plasmodium vivax plasmepsin IV, putative 0.0081 0.0641 1
Toxoplasma gondii type I fatty acid synthase, putative 0.0026 0.0097 0.1518
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.0019 0.003 0.1398
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0023 0.0067 0.0037
Echinococcus granulosus integrin alpha ps 0.0081 0.0637 0.0734
Brugia malayi neuroendocrine convertase 1 precursor 0.0276 0.2541 0.2518
Brugia malayi endoprotease bli-4 precursor 0.0439 0.4133 0.4116
Schistosoma mansoni hypothetical protein 0.0081 0.0635 0.0743
Plasmodium falciparum plasmepsin VI 0.0081 0.0641 1
Mycobacterium ulcerans polyketide synthase Pks13 0.0036 0.0199 1
Chlamydia trachomatis protoporphyrinogen oxidase 0.0028 0.0124 0.5
Loa Loa (eye worm) hypothetical protein 0.004 0.0243 0.0213
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Mycobacterium tuberculosis Conserved hypothetical protein 0.0028 0.0124 0.5873
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0067 0.0037
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0026 0.0097 0.4429
Loa Loa (eye worm) hypothetical protein 0.0172 0.1528 0.1503
Trypanosoma cruzi UDP-galactopyranose mutase 0.0028 0.0124 1
Schistosoma mansoni hypothetical protein 0.0054 0.0377 0.0426
Mycobacterium ulcerans dehydrogenase 0.0028 0.0124 0.6156
Onchocerca volvulus 0.0045 0.0287 0.1689
Onchocerca volvulus CoRest homolog 0.0174 0.1549 1
Echinococcus granulosus neuroendocrine convertase 2 0.0276 0.2541 0.3037
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0081 0.0641 0.0613
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0054 0.0377 0.042
Echinococcus granulosus integrin alpha 3 0.0138 0.1198 0.1413
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.1546 0.1861
Brugia malayi Integrin beta pat-3 precursor 0.0369 0.3457 0.3437
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Trichomonas vaginalis leucine-rich repeat protein, BspA family 0.0085 0.0676 0.2667
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0024 0.0083 0.4065
Brugia malayi Kelch motif family protein 0.0056 0.0396 0.0366
Echinococcus multilocularis integrin alpha ps 0.0081 0.0637 0.0734
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.1546 0.1861
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0054 0.0377 0.0348
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0267 0.2452 1
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0023 0.0067 0.2782
Trichomonas vaginalis hypothetical protein 0.0085 0.0676 0.2667
Giardia lamblia High cysteine membrane protein Group 2 0.0163 0.144 1
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0081 0.0641 0.0739
Mycobacterium tuberculosis Possible oxidoreductase 0.0028 0.0124 0.5873
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0054 0.0377 0.042
Loa Loa (eye worm) hypothetical protein 0.0139 0.1208 0.1181
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0019 0.0037 0.172
Schistosoma mansoni hypothetical protein 0.0054 0.0377 0.0426
Mycobacterium leprae Polyketide synthase Pks13 0.0036 0.0199 1
Brugia malayi aspartic protease BmAsp-2, identical 0.0045 0.0287 0.0257
Schistosoma mansoni hypothetical protein 0.0081 0.0635 0.0743
Toxoplasma gondii subtilisin SUB7 0.0019 0.003 0.0474
Echinococcus multilocularis protoporphyrinogen oxidase 0.0028 0.0124 0.0113
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Plasmodium falciparum protoporphyrinogen oxidase 0.0028 0.0124 0.1528
Onchocerca volvulus 0.0023 0.0067 0.0243
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0023 0.0076 0.3234
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0046 0.0294 0.0264
Loa Loa (eye worm) hypothetical protein 0.0056 0.0396 0.0366
Toxoplasma gondii subtilisin SUB11 0.0019 0.003 0.0474
Echinococcus granulosus integrin alpha ps 0.0039 0.0226 0.0236
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.0019 0.003 0.1398
Mycobacterium ulcerans monoamine oxidase 0.0028 0.0124 0.6156
Mycobacterium tuberculosis Probable thioesterase TesA 0.002 0.0043 0.1481
Toxoplasma gondii subtilisin SUB5 0.0019 0.003 0.0474
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0124 0.1528
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0081 0.0635 0.0607
Plasmodium falciparum plasmepsin VII 0.0045 0.0287 0.4198
Onchocerca volvulus Fatty acid synthase homolog 0.0043 0.0272 0.159
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0024 0.0083 0.3628
Schistosoma mansoni integrin alpha 0.018 0.161 0.194
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0036 0.0199 1
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.0019 0.003 0.0766
Toxoplasma gondii subtilisin SUB10 0.0019 0.003 0.0474
Schistosoma mansoni apoptosis regulator bax 0.0054 0.0377 0.0426
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.068 0.6489 0.7812
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0028 0.0124 0.1528
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.002 0.004 0.1281
Toxoplasma gondii histone lysine-specific demethylase 0.0028 0.0124 0.193
Loa Loa (eye worm) integrin beta-2 0.0369 0.3457 0.3437
Plasmodium falciparum plasmepsin III 0.0045 0.0287 0.4198
Loa Loa (eye worm) hypothetical protein 0.0042 0.0259 0.0229
Echinococcus multilocularis integrin alpha ps 0.0081 0.0637 0.0734
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Toxoplasma gondii aspartyl protease ASP3 0.0045 0.0287 0.4473
Loa Loa (eye worm) hypothetical protein 0.0136 0.118 0.1153
Plasmodium falciparum plasmepsin X 0.0045 0.0287 0.4198
Loa Loa (eye worm) hypothetical protein 0.0054 0.0377 0.0348
Brugia malayi hypothetical protein 0.0028 0.0124 0.0094
Brugia malayi Latrophilin receptor protein 2 0.0081 0.0635 0.0607
Schistosoma mansoni integrin beta subunit 0.0218 0.1973 0.2386
Brugia malayi amine oxidase, flavin-containing family protein 0.004 0.0239 0.0209
Loa Loa (eye worm) hypothetical protein 0.004 0.0239 0.0209
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Loa Loa (eye worm) aspartyl protease 6 0.0045 0.0287 0.0257
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0439 0.4133 0.504
Loa Loa (eye worm) hypothetical protein 0.0045 0.0287 0.0257
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0024 0.0083 0.4065
Schistosoma mansoni memapsin-2 (A01 family) 0.0852 0.8172 1
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.068 0.6489 0.7812
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.0083 0.4065
Loa Loa (eye worm) hypothetical protein 0.0174 0.155 0.1524
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Brugia malayi hypothetical protein 0.0056 0.0396 0.0366
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Brugia malayi proprotein convertase 2 0.0276 0.2541 0.2518
Echinococcus multilocularis GPCR, family 2 0.0081 0.0635 0.0732
Echinococcus granulosus Furin 1 0.0104 0.086 0.1003
Trypanosoma brucei serine peptidase, clan SB, family S8-like protein 0.0019 0.003 0.5
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0267 0.2452 0.293
Plasmodium vivax aspartyl proteinase, putative 0.0045 0.0287 0.4198
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0196
Schistosoma mansoni amine oxidase 0.0028 0.0124 0.0115
Schistosoma mansoni amine oxidase 0.0028 0.0124 0.0115
Toxoplasma gondii aspartyl protease ASP1 0.0081 0.0641 1
Echinococcus granulosus integrin beta 2 0.0274 0.2521 0.3013
Plasmodium falciparum plasmepsin II 0.0081 0.0641 1
Loa Loa (eye worm) hypothetical protein 0.0099 0.0819 0.0791
Toxoplasma gondii subtilisin SUB6 0.0019 0.003 0.0474
Echinococcus multilocularis 0.0028 0.0124 0.0113
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Schistosoma mansoni hypothetical protein 0.0174 0.155 0.1866
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0045 0.0287 0.0315
Loa Loa (eye worm) integrin alpha pat-2 0.0278 0.2564 0.2541
Trypanosoma brucei subtilisin peptidase 0.0019 0.003 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0124 0.0094
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0267 0.2452 0.293
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0255 0.2338 0.2315
Mycobacterium leprae Possible secreted protease 0.0019 0.003 0.1398
Trichomonas vaginalis proprotein convertase subtilisin/kexin type, putative 0.0085 0.0676 0.2667
Plasmodium vivax aspartyl protease, putative 0.0045 0.0287 0.4198
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0045 0.0287 0.4473
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0104 0.086 0.3423
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0136 0.118 0.1153
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0139 0.1208 0.1425
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.0019 0.003 0.0766
Plasmodium falciparum plasmepsin V 0.0045 0.0287 0.4198
Schistosoma mansoni furin-1 (S08 family) 0.0191 0.1712 0.2065
Plasmodium falciparum plasmepsin VIII, putative 0.0045 0.0287 0.4198
Toxoplasma gondii subtilisin SUB12 0.0019 0.003 0.0474
Onchocerca volvulus 0.0151 0.1323 0.8515
Toxoplasma gondii subtilisin SUB2 0.0019 0.003 0.0474
Mycobacterium ulcerans Type I modular polyketide synthase 0.0024 0.0083 0.4065
Brugia malayi Eukaryotic aspartyl protease family protein 0.0045 0.0287 0.0257
Toxoplasma gondii subtilisin SUB8 0.0019 0.003 0.0474
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0676 0.2667
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0026 0.0097 0.4429
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0028 0.0124 0.1528
Brugia malayi Pepsin A precursor 0.0045 0.0287 0.0257
Mycobacterium leprae Probable polyketide synthase Pks1 0.0026 0.0097 0.481
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0081 0.0635 0.0732
Brugia malayi hypothetical protein 0.0045 0.0287 0.0257

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) 0 Inhibition of v-ATPase activity in rat brain synaptic vesicles ChEMBL. 17662605
Inhibition (binding) = 13 % Inhibition of [3H]glutamate uptake at VGLUT in rat brain synaptic vesicles relative to control ChEMBL. 17662605

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.