Detailed information for compound 1443256

Basic information

Technical information
  • TDR Targets ID: 1443256
  • Name: N'-[(2-chlorophenyl)methyl]-N-[(3-thiophen-2- ylsulfonyl-1,3-oxazolidin-2-yl)methyl]oxamide
  • MW: 443.925 | Formula: C17H18ClN3O5S2
  • H donors: 2 H acceptors: 4 LogP: 2.02 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C(=O)NCc1ccccc1Cl)NCC1OCCN1S(=O)(=O)c1cccs1
  • InChi: 1S/C17H18ClN3O5S2/c18-13-5-2-1-4-12(13)10-19-16(22)17(23)20-11-14-21(7-8-26-14)28(24,25)15-6-3-9-27-15/h1-6,9,14H,7-8,10-11H2,(H,19,22)(H,20,23)
  • InChiKey: VTALHWPVTWTCLB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N'-[(2-chlorophenyl)methyl]-N-[[3-(2-thienylsulfonyl)oxazolidin-2-yl]methyl]oxamide
  • N'-[(2-chlorophenyl)methyl]-N-[[3-(2-thienylsulfonyl)-2-oxazolidinyl]methyl]oxamide
  • N'-(2-chlorobenzyl)-N-[[3-(2-thienylsulfonyl)oxazolidin-2-yl]methyl]oxamide
  • N'-[(2-chlorophenyl)methyl]-N-[(3-thiophen-2-ylsulfonyl-1,3-oxazolidin-2-yl)methyl]ethanediamide
  • MLS000685886
  • SMR000324752

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.0081 0.0343 1
Trypanosoma brucei serine peptidase, clan SB, family S8-like protein 0.0081 0.0343 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Trichomonas vaginalis conserved hypothetical protein 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0292 0.0379
Onchocerca volvulus 0.0099 0.0456 1
Toxoplasma gondii subtilisin SUB7 0.0081 0.0343 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Loa Loa (eye worm) hypothetical protein 0.0093 0.0415 0.0396
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0178 0.0178
Trichomonas vaginalis proprotein convertase subtilisin/kexin type, putative 0.0419 0.2476 0.4541
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus granulosus caspase 2 0.003 0.002 0.002
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Brugia malayi Tachykinin-like peptides receptor 99D 0.0233 0.1302 0.1284
Loa Loa (eye worm) subtilase 0.0081 0.0343 0.0324
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0548 0.3295 0.4271
Echinococcus multilocularis 0.1241 0.7671 0.9944
Echinococcus granulosus epidermal growth factor receptor 0.0264 0.1499 0.1499
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus multilocularis membrane bound transcription factor site 1 0.0081 0.0343 0.0445
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Brugia malayi Trypsin family protein 0.0099 0.0456 0.0437
Plasmodium vivax subtilisin-like protease 2, putative 0.0081 0.0343 0.5
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0132 0.0662 0.0643
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0178 0.023
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.05 0.2991 0.2977
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis leucine-rich repeat protein, BspA family 0.0368 0.2158 0.392
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0099 0.0456 0.0437
Onchocerca volvulus 0.0093 0.0415 0.906
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0093 0.0415 0.0396
Echinococcus multilocularis Furin 1 0.05 0.2991 0.3877
Toxoplasma gondii subtilisin SUB5 0.0081 0.0343 1
Loa Loa (eye worm) hypothetical protein 0.0798 0.487 0.486
Plasmodium vivax subtilisin-like serine protease, putative 0.0081 0.0343 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0178 0.0158
Echinococcus granulosus apoptotic protease activating factor 1 0.003 0.002 0.002
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0093 0.0415 0.0396
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0081 0.0343 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Echinococcus granulosus membrane bound transcription factor site 1 0.0081 0.0343 0.0343
Brugia malayi proprotein convertase 2 0.1248 0.7714 0.771
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.0081 0.0343 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0099 0.0456 0.0437
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus granulosus peptidase s8 s53 subtilisin kexin sedolisin 0.0081 0.0343 0.0343
Echinococcus multilocularis apoptotic protease activating factor 1 0.003 0.002 0.0026
Brugia malayi MH2 domain containing protein 0.0144 0.074 0.0722
Trypanosoma brucei subtilisin peptidase 0.0081 0.0343 0.5
Loa Loa (eye worm) proprotein convertase 2 0.05 0.2991 0.2977
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Toxoplasma gondii subtilisin SUB6 0.0081 0.0343 1
Brugia malayi Hypothetical subtilase-type proteinase F21H12.6 in chromosome II 0.0081 0.0343 0.0324
Trichomonas vaginalis conserved hypothetical protein 0.0081 0.0343 0.0382
Loa Loa (eye worm) hypothetical protein 0.0233 0.1302 0.1284
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Toxoplasma gondii subtilisin SUB8 0.0081 0.0343 1
Echinococcus granulosus dnaJ subfamily B 0.0418 0.247 0.247
Echinococcus granulosus Furin 1 0.05 0.2991 0.2991
Trypanosoma cruzi serine peptidase, clan SB, family S8-like protein 0.0081 0.0343 0.5
Onchocerca volvulus 0.0081 0.0343 0.7423
Echinococcus multilocularis neuroendocrine convertase 2 0.1248 0.7714 1
Trichomonas vaginalis hypothetical protein 0.0368 0.2158 0.392
Echinococcus granulosus furin 0.1609 1 1
Loa Loa (eye worm) hypothetical protein 0.1609 1 1
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0292 0.0273
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Leishmania major subtilisin-like serine peptidase 0.0081 0.0343 1
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0081 0.0343 0.5
Brugia malayi Subtilase family protein 0.0081 0.0343 0.0324
Brugia malayi celfurPC protein 0.1241 0.7671 0.7666
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.0081 0.0343 1
Echinococcus granulosus inhibitor of apoptosis protein 0.0093 0.0415 0.0415
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0178 0.0158
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0178 0.0158
Schistosoma mansoni site-1 peptidase (S08 family) 0.0081 0.0343 0.0324
Loa Loa (eye worm) hypothetical protein 0.0099 0.0456 0.0437
Trichomonas vaginalis neuroendocrine convertase 2 precursor, putative 0.0419 0.2476 0.4541
Echinococcus multilocularis Peptidase S8 S53, subtilisin kexin sedolisin 0.0081 0.0343 0.0445
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Schistosoma mansoni tripeptidyl-peptidase II (S08 family) 0.0081 0.0343 0.0324
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.0081 0.0343 1
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Echinococcus granulosus neuropeptide FF receptor 2 0.0233 0.1302 0.1302
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0862 0.5277 1
Schistosoma mansoni hypothetical protein 0.0418 0.247 0.2456
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0132 0.0662 0.1003
Trichomonas vaginalis conserved hypothetical protein 0.0081 0.0343 0.0382
Loa Loa (eye worm) hypothetical protein 0.0099 0.0456 0.0437
Plasmodium falciparum subtilisin-like protease 1 0.0081 0.0343 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0178 0.023
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.0081 0.0343 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0862 0.5277 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.074 0.0722
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.1609 1 1
Echinococcus multilocularis dnaJ subfamily B 0.0418 0.247 0.3202
Schistosoma mansoni hypothetical protein 0.0368 0.2158 0.2142
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Toxoplasma gondii subtilisin SUB12 0.0081 0.0343 1
Brugia malayi neuroendocrine convertase 1 precursor 0.1566 0.9728 0.9727
Schistosoma mansoni hypothetical protein 0.0093 0.0415 0.0396
Giardia lamblia Furin precursor putative serine protease 0.0419 0.2476 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0292 0.0292
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0178 0.0158
Plasmodium falciparum subtilisin-like protease 2 0.0081 0.0343 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0292 0.0273
Loa Loa (eye worm) hypothetical protein 0.0081 0.0343 0.0324
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.074 0.0722
Schistosoma mansoni inhibitor of apoptosis protein 0.0093 0.0415 0.0396
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0178 0.0178
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0178 0.0158
Mycobacterium leprae Possible secreted protease 0.0081 0.0343 0.5
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.0081 0.0343 1
Toxoplasma gondii subtilisin SUB1 0.0081 0.0343 1
Toxoplasma gondii subtilisin SUB4 0.0081 0.0343 1
Trypanosoma cruzi subtilisin peptidase 0.0081 0.0343 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.0081 0.0343 1
Plasmodium vivax subtilisin-like protease 1 0.0081 0.0343 0.5
Schistosoma mansoni furin-1 (S08 family) 0.0829 0.5066 0.5057
Schistosoma mansoni tyrosine kinase 0.0264 0.1499 0.1482
Echinococcus multilocularis neuropeptide FF receptor 2 0.0233 0.1302 0.1687
Echinococcus granulosus tm gpcr rhodopsin 0.0548 0.3295 0.3295
Plasmodium falciparum subtilisin-like protease 3 0.0081 0.0343 0.5
Schistosoma mansoni site-1 peptidase (S08 family) 0.0081 0.0343 0.0324
Toxoplasma gondii subtilisin SUB9 0.0081 0.0343 1
Echinococcus multilocularis caspase 2 0.003 0.002 0.0026
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0862 0.5277 0.684
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Trichomonas vaginalis conserved hypothetical protein 0.0081 0.0343 0.0382
Onchocerca volvulus 0.005 0.0148 0.2933
Echinococcus multilocularis epidermal growth factor receptor 0.0264 0.1499 0.1943
Toxoplasma gondii subtilisin SUB11 0.0081 0.0343 1
Toxoplasma gondii subtilisin SUB2 0.0081 0.0343 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0081 0.0343 0.0382
Onchocerca volvulus 0.009 0.04 0.872
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Echinococcus granulosus neuroendocrine convertase 2 0.1248 0.7714 0.7714
Trichomonas vaginalis conserved hypothetical protein 0.0081 0.0343 0.0382
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.05 0.2991 0.5544
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.0081 0.0343 1
Echinococcus granulosus baculoviral IAP repeat containing protein 0.0093 0.0415 0.0415
Loa Loa (eye worm) endoprotease bli-4 0.1609 1 1
Brugia malayi Furin-like cysteine rich region family protein 0.0264 0.1499 0.1482
Toxoplasma gondii subtilisin SUB10 0.0081 0.0343 1
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.0081 0.0343 1
Loa Loa (eye worm) hypothetical protein 0.0093 0.0415 0.0396
Trichomonas vaginalis conserved hypothetical protein 0.0368 0.2158 0.392
Onchocerca volvulus Deterin homolog 0.0093 0.0415 0.906
Schistosoma mansoni inhibitor of apoptosis (iap) domain family member 0.0093 0.0415 0.0396
Echinococcus multilocularis baculoviral IAP repeat containing protein 0.0093 0.0415 0.0537
Echinococcus multilocularis inhibitor of apoptosis protein 0.0093 0.0415 0.0537
Brugia malayi Membrane-bound transcription factor site-1 protease precursor 0.0081 0.0343 0.0324
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0862 0.5277 0.5277
Loa Loa (eye worm) hypothetical protein 0.0369 0.2161 0.2145
Loa Loa (eye worm) TK/EGFR protein kinase 0.0264 0.1499 0.1482

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.122 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 3.5481 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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.
 
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

No literature references available for this target.

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