Detailed information for compound 22647

Basic information

Technical information
  • TDR Targets ID: 22647
  • Name: 1-[[(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-sulfany lpropanoyl]amino]propanoyl]amino]cyclopentane -1-carboxylic acid
  • MW: 440.555 | Formula: C24H28N2O4S
  • H donors: 3 H acceptors: 4 LogP: 3.84 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: S[C@H](C(=O)N[C@H](C(=O)NC1(CCCC1)C(=O)O)Cc1ccccc1)Cc1ccccc1
  • InChi: 1S/C24H28N2O4S/c27-21(26-24(23(29)30)13-7-8-14-24)19(15-17-9-3-1-4-10-17)25-22(28)20(31)16-18-11-5-2-6-12-18/h1-6,9-12,19-20,31H,7-8,13-16H2,(H,25,28)(H,26,27)(H,29,30)/t19-,20-/m0/s1
  • InChiKey: XSZBFGPCIQODHJ-PMACEKPBSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[[(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-sulfanyl-propanoyl]amino]propanoyl]amino]cyclopentanecarboxylic acid
  • 1-[[(2S)-2-[[(2S)-2-mercapto-1-oxo-3-phenylpropyl]amino]-1-oxo-3-phenylpropyl]amino]cyclopentanecarboxylic acid
  • 1-[[(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-sulfanyl-propanoyl]amino]propanoyl]amino]cyclopentane-1-carboxylic acid
  • 1-[[(2S)-2-[[(2S)-2-mercapto-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]cyclopentanecarboxylic acid
  • 1-[[(2S)-2-[[(2S)-2-mercapto-1-oxo-3-phenylpropyl]amino]-1-oxo-3-phenylpropyl]amino]-1-cyclopentanecarboxylic acid
  • 1-[[(2S)-2-[[(2S)-2-mercapto-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]amino]cyclopentane-1-carboxylic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Oryctolagus cuniculus Neprilysin Starlite/ChEMBL References
Rattus norvegicus Angiotensin-converting enzyme Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) peptidase family M13 containing protein Get druggable targets OG5_127344 All targets in OG5_127344
Schistosoma japonicum IPR000718,Peptidase M13, neprilysin,domain-containing Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Schistosoma japonicum ko:K01415 endothelin-converting enzyme [EC3.4.24.71], putative Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) angiotensin-converting enzyme family protein Get druggable targets OG5_131988 All targets in OG5_131988
Echinococcus granulosus endothelin converting enzyme 1 Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Brugia malayi Angiotensin-converting enzyme family protein Get druggable targets OG5_131988 All targets in OG5_131988
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Schistosoma mansoni family M13 unassigned peptidase (M13 family) Get druggable targets OG5_127344 All targets in OG5_127344
Toxoplasma gondii peptidase family M13 protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Brugia malayi Peptidase family M13 containing protein Get druggable targets OG5_127344 All targets in OG5_127344
Onchocerca volvulus Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) peptidase family M13 containing protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 Get druggable targets OG5_127344 All targets in OG5_127344
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 Get druggable targets OG5_127344 All targets in OG5_127344
Mycobacterium ulcerans zinc metalloprotease Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Echinococcus multilocularis endothelin converting enzyme 1 Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
Mycobacterium leprae probable zinc metalloprotease Get druggable targets OG5_127344 All targets in OG5_127344
Neospora caninum hypothetical protein Get druggable targets OG5_127344 All targets in OG5_127344
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma japonicum Endothelin-converting enzyme 2, putative Neprilysin   750 aa 787 aa 21.2 %
Onchocerca volvulus Neprilysin   750 aa 682 aa 31.4 %
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) Neprilysin   750 aa 773 aa 20.7 %
Onchocerca volvulus Neprilysin   750 aa 713 aa 33.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.0075 0.0249 0.0292
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.0075 0.0249 0.027
Leishmania major acetyl-CoA carboxylase, putative 0.0196 0.087 0.0953
Brugia malayi hypothetical protein 0.0093 0.0343 0.0343
Trypanosoma brucei ribonucleoside-diphosphate reductase small chain 0.0141 0.0587 0.0642
Loa Loa (eye worm) hypothetical protein 0.0084 0.0299 0.029
Loa Loa (eye worm) hypothetical protein 0.0114 0.0451 0.0442
Echinococcus granulosus kelch ECH associated protein 1 like 0.0097 0.0363 0.0396
Mycobacterium ulcerans zinc metalloprotease 0.0114 0.0451 0.0532
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0058 0.0162 0.0174
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0028 0.0009 0.0007
Leishmania major eukaryotic initiation factor 4a, putative 0.0051 0.0128 0.0138
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.0075 0.0249 0.027
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0058 0.0162 0.0174
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.0189 0.0835 0.0826
Echinococcus multilocularis eukaryotic initiation factor 4A III 0.0051 0.0128 0.0138
Plasmodium falciparum eukaryotic initiation factor 4A 0.0051 0.0128 0.0019
Leishmania major ribonucleoside-diphosphate reductase large chain, putative 0.1803 0.9105 1
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.003 0.0019 0.0018
Entamoeba histolytica DEAD/DEAH box helicase, putative 0.0051 0.0128 1
Schistosoma mansoni neprilysin-2 (M13 family) 0.0058 0.0162 0.0174
Echinococcus granulosus endothelin converting enzyme 1 0.0114 0.0451 0.0492
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0114 0.0451 0.0492
Chlamydia trachomatis transcriptional repressor NrdR 0.0132 0.0545 0.0596
Trypanosoma cruzi ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0642
Toxoplasma gondii peptidase family M13 protein 0.0114 0.0451 0.0492
Plasmodium vivax ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0529
Trypanosoma cruzi ribonucleoside-diphosphate reductase large chain, putative 0.0513 0.2493 0.2736
Loa Loa (eye worm) hypothetical protein 0.0114 0.0451 0.0442
Echinococcus granulosus ribonucleoside diphosphate reductase subunit 0.0141 0.0587 0.0642
Mycobacterium tuberculosis Ribonucleoside-diphosphate reductase (alpha chain) NrdE (ribonucleotide reductase small subunit) (R1F protein) 0.1671 0.8427 1
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Plasmodium falciparum ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0529
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.1978 1 1
Chlamydia trachomatis ribonucleoside-diphosphate reductase subunit beta 0.0141 0.0587 0.0642
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 0.0114 0.0451 0.0532
Mycobacterium tuberculosis Ribonucleoside-diphosphate reductase (beta chain) NrdF1 (ribonucleotide reductase small subunit) (R2F protein) 0.0141 0.0587 0.0693
Loa Loa (eye worm) integrin beta-2 0.0612 0.3 0.2994
Loa Loa (eye worm) hypothetical protein 0.0051 0.0128 0.0119
Mycobacterium tuberculosis Probable ribonucleoside-diphosphate reductase (large subunit) NrdZ (ribonucleotide reductase) 0.0601 0.2944 0.3492
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Schistosoma mansoni neprilysin 0.003 0.0019 0.0018
Brugia malayi Integrin beta pat-3 precursor 0.0612 0.3 0.3
Brugia malayi ribonucleotide reductase 2 0.0141 0.0587 0.0587
Echinococcus multilocularis Kelch repeat type 1 0.0097 0.0364 0.0397
Echinococcus granulosus eukaryotic initiation factor 4A III 0.0051 0.0128 0.0138
Echinococcus multilocularis eukaryotic initiation factor 4A 0.0051 0.0128 0.0138
Chlamydia trachomatis ribonucleoside-diphosphate reductase subunit alpha 0.1803 0.9105 1
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.0196 0.087 0.0953
Mycobacterium leprae RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE (ALPHA CHAIN) NRDE (RIBONUCLEOTIDE REDUCTASE SMALL SUBUNIT) (R1F PROTEIN) 0.1671 0.8427 1
Leishmania major ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0642
Schistosoma mansoni endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase) 0.0028 0.0009 0.0007
Schistosoma mansoni endothelin-converting enzyme-related 0.0028 0.0009 0.0007
Echinococcus multilocularis integrin beta 2 0.0453 0.2188 0.2401
Loa Loa (eye worm) peptidase family M13 containing protein 0.0084 0.0299 0.029
Toxoplasma gondii pyruvate carboxylase 0.0075 0.0249 0.027
Onchocerca volvulus 0.0056 0.0156 1
Echinococcus multilocularis ribonucleoside diphosphate reductase large 0.1803 0.9105 1
Brugia malayi ribonucleoside-diphosphate reductase large chain, putative 0.1803 0.9105 0.9105
Plasmodium vivax ribonucleoside-diphosphate reductase large chain, putative 0.1803 0.9105 1
Mycobacterium ulcerans transcriptional regulator NrdR 0.0132 0.0545 0.0644
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Schistosoma mansoni pyruvate carboxylase 0.0075 0.0249 0.027
Chlamydia trachomatis biotin carboxylase 0.0068 0.0214 0.0232
Leishmania major eukaryotic initiation factor 4a, putative 0.0051 0.0128 0.0138
Toxoplasma gondii ribonucleoside-diphosphate reductase large chain 0.1803 0.9105 1
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.0075 0.0249 0.0292
Trichomonas vaginalis ribonucleoside-diphosphate reductase alpha chain, putative 0.1671 0.8427 1
Loa Loa (eye worm) ribonucleoside-diphosphate reductase large subunit 0.1803 0.9105 0.9104
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0142 0.0593 0.0536
Loa Loa (eye worm) ribonucleotide reductase M2 B 0.0141 0.0587 0.0578
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Leishmania major carboxylase, putative 0.0075 0.0249 0.027
Trypanosoma cruzi acetyl-CoA carboxylase 0.0121 0.0488 0.0533
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0028 0.0009 0.0007
Mycobacterium tuberculosis Probable transcriptional regulatory protein NrdR 0.0132 0.0545 0.0644
Echinococcus granulosus acetyl coenzyme A carboxylase 1 0.0196 0.087 0.0953
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0093 0.0343 0.0334
Trypanosoma cruzi ribonucleoside-diphosphate reductase large chain, putative 0.1803 0.9105 1
Brugia malayi Carboxyl transferase domain containing protein 0.0189 0.0835 0.0835
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Echinococcus granulosus integrin beta 2 0.0453 0.2188 0.2401
Schistosoma mansoni ribonucleoside-diphosphate reductase small chain 0.0141 0.0587 0.0642
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0075 0.0249 0.027
Toxoplasma gondii eukaryotic initiation factor-4A, putative 0.0051 0.0128 0.0138
Mycobacterium leprae probable zinc metalloprotease 0.0114 0.0451 0.0532
Trypanosoma brucei ribonucleoside-diphosphate reductase small chain 0.0048 0.0111 0.0119
Leishmania major ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0642
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0075 0.0249 0.027
Schistosoma mansoni acetyl-CoA carboxylase 0.0196 0.087 0.0953
Plasmodium falciparum ribonucleoside-diphosphate reductase large subunit, putative 0.1803 0.9105 1
Loa Loa (eye worm) hypothetical protein 0.0084 0.0299 0.029
Schistosoma mansoni integrin beta subunit 0.036 0.1712 0.1878
Loa Loa (eye worm) hypothetical protein 0.0056 0.0156 0.0147
Loa Loa (eye worm) peptidase family M13 containing protein 0.0084 0.0299 0.029
Echinococcus granulosus kelch ECH associated protein 1 0.0097 0.0363 0.0396
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Treponema pallidum ribonucleotide-diphosphate reductase subunit alpha 0.1803 0.9105 1
Loa Loa (eye worm) hypothetical protein 0.0084 0.0299 0.029
Mycobacterium leprae conserved hypothetical protein 0.0132 0.0545 0.0644
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.0075 0.0249 0.0292
Loa Loa (eye worm) hypothetical protein 0.0093 0.0343 0.0334
Mycobacterium tuberculosis Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog) 0.0051 0.0128 0.0149
Echinococcus granulosus ribonucleoside diphosphate reductase large 0.1803 0.9105 1
Loa Loa (eye worm) hypothetical protein 0.0084 0.0299 0.029
Toxoplasma gondii ribonucleoside-diphosphate reductase small subunit 0.0141 0.0587 0.0642
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.0075 0.0249 0.0292
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0051 0.0128 0.0138
Schistosoma mansoni ribonucleoside-diphosphate reductase alpha subunit 0.1803 0.9105 1
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.0075 0.0249 0.0292
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Schistosoma mansoni Nep2 peptidase (M13 family) 0.0058 0.0162 0.0174
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0058 0.0162 0.0174
Plasmodium vivax RNA helicase-1, putative 0.0051 0.0128 0.0019
Wolbachia endosymbiont of Brugia malayi ribonucleotide-diphosphate reductase subunit beta 0.0141 0.0587 0.0693
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0075 0.0249 0.027
Trypanosoma brucei ribonucleoside-diphosphate reductase small chain 0.0141 0.0587 0.0642
Brugia malayi Kelch motif family protein 0.0093 0.0343 0.0343
Echinococcus multilocularis kelch ECH associated protein 1 0.0097 0.0363 0.0396
Brugia malayi peptidase family M13 containing protein 0.0028 0.0009 0.0009
Mycobacterium ulcerans ribonucleotide-diphosphate reductase subunit beta 0.0048 0.0111 0.0128
Trypanosoma brucei acetyl-CoA carboxylase 0.0196 0.087 0.0953
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 0.0114 0.0451 0.0451
Treponema pallidum ribonucleotide-diphosphate reductase subunit beta 0.0141 0.0587 0.0511
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0051 0.0128 0.0138
Echinococcus granulosus kelch ECH associated protein 1 like 0.0097 0.0363 0.0396
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0075 0.0249 0.027
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0028 0.0009 0.0007
Mycobacterium leprae RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE (BETA CHAIN) NRDF (RIBONUCLEOTIDE REDUCTASE SMALL SUBUNIT) (R2F PROTEIN) 0.0048 0.0111 0.0128
Wolbachia endosymbiont of Brugia malayi ribonucleotide-diphosphate reductase subunit alpha 0.1671 0.8427 1
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0075 0.0249 0.027
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0075 0.0249 0.027
Trypanosoma brucei ribonucleoside-diphosphate reductase large chain 0.1803 0.9105 1
Trypanosoma cruzi ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0642
Echinococcus granulosus eukaryotic initiation factor 4A 0.0051 0.0128 0.0138
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.0196 0.087 0.0953
Schistosoma mansoni hypothetical protein 0.003 0.0019 0.0018
Schistosoma mansoni hypothetical protein 0.0097 0.0364 0.0397
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0051 0.0128 0.0138
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.0075 0.0249 0.027
Trypanosoma brucei ribonucleoside-diphosphate reductase small chain 0.0141 0.0587 0.0642
Loa Loa (eye worm) hypothetical protein 0.0114 0.0451 0.0442
Mycobacterium tuberculosis Ribonucleoside-diphosphate reductase (beta chain) NrdB (ribonucleotide reductase small chain) 0.0141 0.0587 0.0693
Echinococcus multilocularis ribonucleoside diphosphate reductase subunit 0.0141 0.0587 0.0642
Trypanosoma brucei unspecified product 0.0049 0.0118 0.0127
Echinococcus multilocularis endothelin converting enzyme 1 0.0114 0.0451 0.0492
Trypanosoma brucei ribonucleoside-diphosphate reductase small chain, putative 0.0141 0.0587 0.0642
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.0075 0.0249 0.0292
Mycobacterium ulcerans ribonucleotide-diphosphate reductase subunit alpha 0.1671 0.8427 1
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0051 0.0128 0.0138
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.0075 0.0249 0.0292
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.0196 0.087 0.0953
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.03
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0028 0.0009 0.0007
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0142 0.0593 0.0536
Brugia malayi Peptidase family M13 containing protein 0.0114 0.0451 0.0451
Brugia malayi eukaryotic initiation factor 4A 0.0051 0.0128 0.0128
Trypanosoma brucei Eukaryotic initiation factor 4A-1 0.0051 0.0128 0.0138
Echinococcus multilocularis kelch ECH associated protein 1 0.0097 0.0363 0.0396
Mycobacterium ulcerans pyruvate carboxylase 0.0075 0.0249 0.0292
Giardia lamblia Translation initiation factor eIF-4A, putative 0.0051 0.0128 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 30 nM Inhibitory activity against angiotensin I converting enzyme ChEMBL. 8632427
IC50 (binding) = 30 nM Inhibitory activity against angiotensin I converting enzyme ChEMBL. 8632427
IC50 (binding) = 45 nM Inhibitory activity was tested against neutral endopeptidase ChEMBL. 8632427
IC50 (binding) = 45 nM Inhibitory activity was tested against neutral endopeptidase ChEMBL. 8632427

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.

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