Detailed information for compound 1370664

Basic information

Technical information
  • TDR Targets ID: 1370664
  • Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]p henyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acet amide
  • MW: 358.415 | Formula: C17H18N4O3S
  • H donors: 1 H acceptors: 4 LogP: 2.58 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1nnc(s1)C)Cc1ccc(cc1)OCc1c(C)noc1C
  • InChi: 1S/C17H18N4O3S/c1-10-15(11(2)24-21-10)9-23-14-6-4-13(5-7-14)8-16(22)18-17-20-19-12(3)25-17/h4-7H,8-9H2,1-3H3,(H,18,20,22)
  • InChiKey: VKTSHQNMUZHTGK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-[(3,5-dimethylisoxazol-4-yl)methoxy]phenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
  • 2-[4-[(3,5-dimethyl-4-isoxazolyl)methoxy]phenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
  • 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide
  • T5346856
  • ZINC03450643
  • MLS000057229
  • SMR000064779

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
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
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Schistosoma mansoni calpain (C02 family) 0.0024 0.0218 0.0392
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0055 0.1413 0.1469
Echinococcus multilocularis calpain family protein 1, d 0.0046 0.1082 0.1124
Plasmodium vivax vivapain-2 0.003 0.0478 0.4859
Onchocerca volvulus 0.0055 0.1413 1
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0982 0.1768
Brugia malayi beta-lactamase family protein 0.0043 0.0984 0.1023
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.1304 0.2348
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0984 0.1023
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0984 0.6588
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0024 0.0218 0.0392
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0024 0.0218 0.146
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.003 0.0478 0.0344
Onchocerca volvulus 0.0039 0.0809 0.5208
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0984 0.6588
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0022 0.0152 0.1018
Schistosoma mansoni Mername-AA248 (C02 family) 0.0024 0.0218 0.0392
Giardia lamblia Cathepsin B precursor 0.0057 0.1493 0.5
Brugia malayi hypothetical protein 0.0043 0.0982 0.1021
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0984 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0022 0.0152 0.1018
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0982 0.1021
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0057 0.1493 0.2688
Schistosoma mansoni calpain-7 (C02 family) 0.0024 0.0218 0.0392
Trypanosoma brucei calpain-like protein, putative 0.0024 0.0218 0.146
Entamoeba histolytica cysteine protease, putative 0.003 0.0478 0.4865
Toxoplasma gondii cathepsin B 0.0057 0.1493 1
Brugia malayi calpain 7 0.0024 0.0218 0.0227
Entamoeba histolytica cysteine proteinase, putative 0.003 0.0478 0.4865
Echinococcus multilocularis cathepsin l cysteine peptidase 0.003 0.0478 0.0497
Loa Loa (eye worm) ctsf protein 0.003 0.0478 0.0344
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0022 0.0152 0.0274
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0024 0.0218 0.146
Loa Loa (eye worm) beta-lactamase 0.0043 0.0984 0.0878
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Schistosoma mansoni survival motor neuron protein 0.0055 0.1413 0.2544
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0984 0.6588
Giardia lamblia Cathepsin B precursor 0.0057 0.1493 0.5
Onchocerca volvulus Cathepsin L homolog 0.003 0.0478 0.2584
Schistosoma mansoni hypothetical protein 0.0043 0.0982 0.1768
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Giardia lamblia Cathepsin B precursor 0.0057 0.1493 0.5
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0984 0.0878
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0162 0.5555 1
Entamoeba histolytica hypothetical protein 0.0043 0.0982 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Plasmodium vivax vivapain-2 0.003 0.0478 0.4859
Leishmania major cysteine peptidase A (CPA) 0.003 0.0478 0.2039
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0024 0.0218 0.0392
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.003 0.0478 0.3201
Loa Loa (eye worm) hypothetical protein 0.0046 0.1082 0.0982
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Echinococcus granulosus family C2 unassigned peptidase C02 family 0.0065 0.1825 0.1898
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0024 0.0218 0.0392
Plasmodium vivax calpain, putative 0.0024 0.0218 0.2216
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0065 0.1825 0.3286
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Brugia malayi beta-lactamase 0.0043 0.0984 0.1023
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.1304 0.1356
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Loa Loa (eye worm) hypothetical protein 0.0063 0.1716 0.1652
Loa Loa (eye worm) cysteine protease 0.003 0.0478 0.0344
Schistosoma mansoni hypothetical protein 0.0055 0.1413 0.2544
Schistosoma mansoni cathepsin F (C01 family) 0.003 0.0478 0.086
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Echinococcus multilocularis cathepsin L cysteine protease 0.003 0.0478 0.0497
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0162 0.5555 1
Echinococcus granulosus survival motor neuron protein 1 0.0268 0.9618 1
Onchocerca volvulus 0.003 0.0478 0.2584
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0063 0.1716 0.3089
Echinococcus granulosus calpain 5 0.0024 0.0218 0.0227
Loa Loa (eye worm) hypothetical protein 0.0268 0.9618 1
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0024 0.0218 0.0392
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0024 0.0218 0.0392
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0984 0.5
Brugia malayi hypothetical protein 0.0268 0.9618 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.003 0.0478 0.0344
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0982 0.1021
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma brucei antigen, putative 0.0024 0.0218 0.146
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus multilocularis cathepsin L cysteine protease 0.003 0.0478 0.0497
Entamoeba histolytica cysteine proteinase, putative 0.003 0.0478 0.4865
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0162 0.5555 1
Loa Loa (eye worm) hypothetical protein 0.0055 0.1443 0.1364
Trypanosoma brucei calpain-like protein, putative 0.0024 0.0218 0.146
Plasmodium falciparum cysteine proteinase falcipain 2a 0.003 0.0478 1
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0057 0.1493 0.2688
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus multilocularis hypothetical protein 0.0024 0.0218 0.0227
Onchocerca volvulus 0.0043 0.0984 0.6595
Mycobacterium ulcerans beta-lactamase 0.0043 0.0984 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Mycobacterium leprae Probable lipase LipE 0.0043 0.0984 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.003 0.0478 0.3201
Echinococcus granulosus calpain A 0.0065 0.1825 0.1898
Leishmania major hypothetical protein, conserved 0.0043 0.0984 0.6005
Plasmodium falciparum cysteine proteinase falcipain 2b 0.003 0.0478 1
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Entamoeba histolytica hypothetical protein 0.0043 0.0982 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.003 0.0478 0.0497
Loa Loa (eye worm) fibroinase 0.003 0.0478 0.0344
Brugia malayi beta-lactamase family protein 0.0043 0.0984 0.1023
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.1304 0.1356
Mycobacterium ulcerans lipase LipD 0.0043 0.0984 0.5
Onchocerca volvulus Cathepsin F homolog 0.003 0.0478 0.2584
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0024 0.0218 0.0392
Schistosoma mansoni calpain C (C02 family) 0.0024 0.0218 0.0392
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0984 0.1771
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Onchocerca volvulus 0.003 0.0478 0.2584
Loa Loa (eye worm) hypothetical protein 0.0162 0.5555 0.5708
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Echinococcus multilocularis calpain 5 0.0024 0.0218 0.0227
Brugia malayi cathepsin L-like precursor 0.0022 0.0152 0.0158
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0984 0.6588
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Schistosoma mansoni calpain-7 (C02 family) 0.0024 0.0218 0.0392
Mycobacterium ulcerans hypothetical protein 0.0043 0.0984 0.5
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0065 0.1825 0.3286
Echinococcus granulosus calpain 0.0024 0.0218 0.0227
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus granulosus cathepsin L cysteine proteinase 0.003 0.0478 0.0497
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Brugia malayi cathepsin B-like cysteine proteinase 0.0162 0.5555 0.5775
Onchocerca volvulus Cathepsin L homolog 0.003 0.0478 0.2584
Plasmodium falciparum cysteine proteinase falcipain 3 0.003 0.0478 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Trypanosoma cruzi cysteine peptidase, putative 0.003 0.0478 0.086
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.1304 0.2348
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0024 0.0218 0.0392
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0024 0.0218 0.0392
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0984 0.1023
Onchocerca volvulus 0.003 0.0478 0.2584
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0984 0.6588
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0984 0.1771
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.1304 0.1356
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Brugia malayi Cathepsin L-like precursor 0.0022 0.0152 0.0158
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0984 0.1023
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus multilocularis cathepsin l cysteine peptidase 0.003 0.0478 0.0497
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0162 0.5555 1
Trypanosoma cruzi cruzipain precursor, putative 0.003 0.0478 0.086
Trypanosoma brucei cysteine peptidase C (CPC) 0.0057 0.1493 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0057 0.1493 1
Trypanosoma cruzi cysteine peptidase, putative 0.003 0.0478 0.086
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0024 0.0218 0.0392
Loa Loa (eye worm) calpain 0.0024 0.0218 0.007
Loa Loa (eye worm) calpain family protein 1 0.0063 0.1716 0.1652
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus multilocularis calpain A 0.0065 0.1825 0.1898
Entamoeba histolytica hypothetical protein 0.0043 0.0982 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0478 0.0344
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.1304 0.1356
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Loa Loa (eye worm) calpain family protein 1 0.0046 0.1082 0.0982
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Onchocerca volvulus 0.0043 0.0984 0.6595
Echinococcus granulosus cathepsin b 0.0162 0.5555 0.5775
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Brugia malayi calpain family protein 1 0.0063 0.1716 0.1784
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0024 0.0218 0.0392
Schistosoma mansoni cathepsin F (C01 family) 0.003 0.0478 0.086
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0162 0.5555 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Loa Loa (eye worm) hypothetical protein 0.0039 0.0809 0.0694
Brugia malayi Cathepsin L-like precursor 0.003 0.0478 0.0497
Echinococcus granulosus cathepsin l1 0.0022 0.0152 0.0158
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Brugia malayi Papain family cysteine protease containing protein 0.003 0.0478 0.0497
Echinococcus multilocularis survival motor neuron protein 1 0.0268 0.9618 1
Onchocerca volvulus 0.0043 0.0984 0.6595
Echinococcus multilocularis cathepsin b 0.0162 0.5555 0.5775
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.003 0.0478 0.3201
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Echinococcus multilocularis cathepsin b 0.0162 0.5555 0.5775
Brugia malayi Cathepsin L-like precursor 0.0022 0.0152 0.0158
Echinococcus multilocularis cysteine protease 0.003 0.0478 0.0497
Toxoplasma gondii ABC1 family protein 0.0043 0.0984 0.4981
Trypanosoma cruzi cysteine peptidase, putative 0.003 0.0478 0.086
Entamoeba histolytica hypothetical protein 0.0043 0.0982 1
Leishmania major cathepsin L-like protease 0.003 0.0478 0.2039
Brugia malayi calpain family protein 1 0.0063 0.1716 0.1784
Loa Loa (eye worm) cathepsin B 0.0057 0.1493 0.1417
Brugia malayi Cathepsin L-like cysteine proteinase 0.0022 0.0152 0.0158
Onchocerca volvulus 0.003 0.0478 0.2584
Echinococcus granulosus cathepsin b 0.0162 0.5555 0.5775
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.003 0.0478 0.3201
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0984 0.5
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0984 1
Trypanosoma brucei calpain-like protein, putative 0.0024 0.0218 0.146
Trypanosoma brucei calpain-like protein, putative 0.0024 0.0218 0.146
Loa Loa (eye worm) hypothetical protein 0.0043 0.0984 0.0878
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0057 0.1493 1
Trypanosoma cruzi cysteine peptidase, putative 0.003 0.0478 0.086
Echinococcus granulosus calpain 7 C02 family 0.0024 0.0218 0.0227
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.1304 0.2348
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.003 0.0478 0.3201
Echinococcus multilocularis calpain 0.0024 0.0218 0.0227
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0984 0.1771
Trichomonas vaginalis esterase, putative 0.0043 0.0984 0.6588
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.1304 0.1356
Echinococcus granulosus calpain A 0.0024 0.0218 0.0227
Echinococcus multilocularis family C2 unassigned peptidase (C02 family) 0.0065 0.1825 0.1898
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.1304 0.1217
Onchocerca volvulus 0.003 0.0478 0.2584
Echinococcus granulosus cathepsin l1 0.003 0.0478 0.0497
Schistosoma mansoni cathepsin F (C01 family) 0.0022 0.0152 0.0274
Echinococcus multilocularis calpain 7 (C02 family) 0.0024 0.0218 0.0227
Onchocerca volvulus 0.003 0.0478 0.2584
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0984 0.1771
Entamoeba histolytica cysteine proteinase, putative 0.0022 0.0152 0.1548
Echinococcus multilocularis cysteine protease 0.003 0.0478 0.0497
Onchocerca volvulus 0.003 0.0478 0.2584
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0984 0.6588

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.1836 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 0.8196 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) = 4.4668 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 6.5733 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
Potency (functional) 20.5962 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 20.5962 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: Inhibitors of TCP-1 ring complex (TRiC) of Methanococcus maripaludis (MmCpn): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488991] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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.
 
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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