Detailed information for compound 1552609

Basic information

Technical information
  • TDR Targets ID: 1552609
  • Name: N-[2-(4-methylsulfanylphenyl)ethyl]-1-morphol in-4-ylsulfonylpiperidine-3-carboxamide
  • MW: 427.581 | Formula: C19H29N3O4S2
  • H donors: 1 H acceptors: 3 LogP: 1.29 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccc(cc1)CCNC(=O)C1CCCN(C1)S(=O)(=O)N1CCOCC1
  • InChi: 1S/C19H29N3O4S2/c1-27-18-6-4-16(5-7-18)8-9-20-19(23)17-3-2-10-22(15-17)28(24,25)21-11-13-26-14-12-21/h4-7,17H,2-3,8-15H2,1H3,(H,20,23)
  • InChiKey: QWKPRMWQOOWHKJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[2-(4-methylsulfanylphenyl)ethyl]-1-morpholinosulfonyl-piperidine-3-carboxamide
  • N-[2-[4-(methylthio)phenyl]ethyl]-1-morpholinosulfonyl-3-piperidinecarboxamide
  • N-[2-[4-(methylthio)phenyl]ethyl]-1-morpholinosulfonyl-nipecotamide
  • N-[2-(4-methylsulfanylphenyl)ethyl]-1-morpholin-4-ylsulfonyl-piperidine-3-carboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1357 0.2885
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0055 0.2146 0.4484
Schistosoma mansoni chromobox protein 0.0072 0.3007 0.2912
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Mycobacterium tuberculosis Conserved hypothetical protein 0.0021 0.0337 0.0364
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.1516 0.1794
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0337 0.1414
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.1721 0.3746
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0742 0.1434
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0097 0.4372 0.4295
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trichomonas vaginalis heat shock protein, putative 0.0047 0.1721 0.3746
Echinococcus granulosus protein kinase shaggy 0.0055 0.2146 0.2039
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.18 0.3627
Brugia malayi glutathione reductase 0.0049 0.18 0.3932
Trypanosoma brucei protein kinase, putative 0.0055 0.2146 0.4909
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0068 0.2817 0.6147
Leishmania major DNA polymerase kappa, putative 0.0021 0.0337 0.0479
Plasmodium falciparum heat shock protein 90, putative 0.0027 0.0687 0.0652
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Entamoeba histolytica protein kinase, putative 0.0055 0.2146 0.4484
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0111 0.5067 0.8837
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0055 0.2146 0.4748
Onchocerca volvulus 0.0055 0.2146 0.3604
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Loa Loa (eye worm) heat shock protein 90 0.0047 0.1721 0.3431
Echinococcus granulosus heat shock protein 90 0.0047 0.1721 0.1609
Echinococcus multilocularis tar DNA binding protein 0.0068 0.2817 0.2719
Brugia malayi TAR-binding protein 0.0068 0.2817 0.6331
Trypanosoma brucei heat shock protein 90, putative 0.0047 0.1721 0.3938
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0337 0.0479
Giardia lamblia Heat shock protein HSP 90-alpha 0.004 0.1364 0.2903
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0097 0.4372 1
Giardia lamblia Heat shock protein HSP 90-alpha 0.0047 0.1721 0.3746
Trypanosoma cruzi Heat shock protein 83, putative 0.0047 0.1721 0.3746
Schistosoma mansoni endoplasmin 0.0047 0.1721 0.1609
Plasmodium vivax heat shock protein 86, putative 0.0047 0.1721 0.1872
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.4372 1
Trichomonas vaginalis chromobox protein, putative 0.0072 0.3007 0.6781
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0021 0.0337 0.0364
Trypanosoma brucei trypanothione reductase 0.0049 0.18 0.4118
Brugia malayi Thioredoxin reductase 0.0049 0.18 0.3932
Schistosoma mansoni tar DNA-binding protein 0.0068 0.2817 0.2719
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0337 0.0771
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Mycobacterium tuberculosis Probable oxidoreductase 0.0123 0.5716 1
Trichomonas vaginalis DNA polymerase eta, putative 0.0021 0.0337 0.0479
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Mycobacterium ulcerans heat shock protein 90 0.0044 0.157 1
Brugia malayi Hsp90 protein 0.0031 0.0892 0.1788
Echinococcus multilocularis protein kinase shaggy 0.0055 0.2146 0.2039
Loa Loa (eye worm) heterochromatin protein 1 0.0072 0.3007 0.6619
Brugia malayi heat shock protein 90 0.0047 0.1721 0.3746
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.0134 0.0307
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0031 0.0892 0.0768
Toxoplasma gondii heat shock protein HSP90 0.0047 0.1721 0.1872
Giardia lamblia Kinase, CMGC GSK 0.0055 0.2146 0.4748
Leishmania major heat shock protein, putative 0.0031 0.0892 0.1788
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0017 0.0134 0.5
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0337 0.0479
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0049 0.18 0.2985
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0123 0.5716 1
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Echinococcus multilocularis dna polymerase kappa 0.0021 0.0337 0.0206
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.0134 0.0307
Trypanosoma cruzi heat shock protein, putative 0.0031 0.0892 0.1788
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0134 0.0307
Plasmodium vivax heat shock protein 90, putative 0.0031 0.0892 0.0894
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0337 0.0771
Plasmodium falciparum endoplasmin, putative 0.0034 0.1044 0.1073
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.004 0.1364 0.1247
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0337 0.0479
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0031 0.0892 0.1375
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Entamoeba histolytica protein kinase domain containing protein 0.0055 0.2146 0.4484
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Brugia malayi serine/threonine-protein kinase plk-2 0.0097 0.4372 1
Plasmodium falciparum thioredoxin reductase 0.0049 0.18 0.1965
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Plasmodium vivax endoplasmin, putative 0.0047 0.1721 0.1872
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Schistosoma mansoni tar DNA-binding protein 0.0068 0.2817 0.2719
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0021 0.0337 0.0479
Loa Loa (eye worm) hypothetical protein 0.0031 0.0902 0.1399
Trichomonas vaginalis heat shock protein, putative 0.004 0.1364 0.2903
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0044 0.157 0.3387
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Trypanosoma cruzi heat shock protein 90, putative 0.002 0.0285 0.0356
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trypanosoma brucei unspecified product 0.0021 0.0337 0.0771
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Trichomonas vaginalis CMGC family protein kinase 0.0055 0.2146 0.4748
Mycobacterium tuberculosis Probable dehydrogenase 0.0111 0.5067 0.8837
Echinococcus multilocularis geminin 0.0205 1 1
Schistosoma mansoni chromobox protein 0.0072 0.3007 0.2912
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Echinococcus granulosus thioredoxin glutathione reductase 0.0049 0.18 0.1689
Echinococcus multilocularis heat shock protein 0.0047 0.1721 0.1609
Plasmodium vivax glutathione reductase, putative 0.0049 0.18 0.1965
Trypanosoma cruzi heat shock protein 90, putative 0.0047 0.1721 0.3746
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Leishmania major trypanothione reductase 0.0049 0.18 0.3932
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Schistosoma mansoni endoplasmin 0.0047 0.1721 0.1609
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0337 0.1414
Onchocerca volvulus Serine\/threonine kinase homolog 0.0097 0.4372 1
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.1721 0.3746
Echinococcus granulosus heat shock protein 90 0.004 0.1364 0.1247
Mycobacterium tuberculosis Probable reductase 0.0111 0.5067 0.8837
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0031 0.0892 0.0768
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0742 0.1434
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0134 0.0307
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0055 0.2146 0.2039
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.18 0.393
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Leishmania major DNA polymerase eta, putative 0.0021 0.0337 0.0479
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0337 0.0479
Loa Loa (eye worm) RNA binding protein 0.0068 0.2817 0.6147
Trypanosoma brucei DNA polymerase eta, putative 0.0021 0.0337 0.0771
Brugia malayi chromobox protein homolog 3 0.004 0.1357 0.2885
Schistosoma mansoni serine/threonine protein kinase 0.0097 0.4372 0.4295
Schistosoma mansoni hypothetical protein 0.0205 1 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0021 0.0337 0.0206
Trichomonas vaginalis conserved hypothetical protein 0.004 0.1357 0.2885
Trypanosoma brucei Heat shock protein 83, putative 0.0047 0.1721 0.3938
Echinococcus multilocularis heat shock protein 90 0.0047 0.1721 0.1609
Onchocerca volvulus 0.0031 0.0902 0.0027
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.18 0.3932
Brugia malayi RNA binding protein 0.0068 0.2817 0.6331
Plasmodium falciparum heat shock protein 90, putative 0.0178 0.8615 1
Echinococcus granulosus chromobox protein 1 0.0072 0.3007 0.2912
Echinococcus multilocularis endoplasmin 0.0044 0.157 0.1455
Plasmodium falciparum heat shock protein 90 0.0047 0.1721 0.1872
Entamoeba histolytica serine/threonine protein kinase, putative 0.0097 0.4372 1
Trichomonas vaginalis heat shock protein, putative 0.0034 0.1044 0.2147
Schistosoma mansoni tar DNA-binding protein 0.0068 0.2817 0.2719
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.1721 0.3746
Toxoplasma gondii heat shock protein 90, putative 0.0047 0.1721 0.1872
Schistosoma mansoni kinase 0.005 0.1867 0.1756
Plasmodium vivax glycogen synthase kinase 3, putative 0.0055 0.2146 0.2373
Trichomonas vaginalis chromobox protein, putative 0.0043 0.1516 0.3262
Loa Loa (eye worm) glutathione reductase 0.0049 0.18 0.3627
Brugia malayi Endoplasmin precursor 0.0047 0.1721 0.3746
Giardia lamblia Kinase, PLK 0.0097 0.4372 1
Toxoplasma gondii thioredoxin reductase 0.0049 0.18 0.1965
Trypanosoma brucei polo-like protein kinase 0.0097 0.4372 1
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0055 0.2146 0.2039
Entamoeba histolytica heat shock protein 90, putative 0.0047 0.1721 0.3431
Toxoplasma gondii heat shock protein 75, putative 0.0031 0.0892 0.0894
Plasmodium falciparum glutathione reductase 0.0049 0.18 0.1965
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0055 0.2146 0.4484
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0123 0.5716 1
Trichomonas vaginalis heat shock protein, putative 0.0044 0.157 0.3387
Entamoeba histolytica protein kinase domain containing protein 0.0055 0.2146 0.4484
Echinococcus multilocularis dna polymerase eta 0.0021 0.0337 0.0206
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0021 0.0337 0.0206
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0111 0.5067 0.8837
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0044 0.157 1
Giardia lamblia Grp94/Hsp90 0.0044 0.157 0.3387
Echinococcus granulosus dna polymerase kappa 0.0021 0.0337 0.0206
Treponema pallidum heat shock protein 90 0.0044 0.157 1
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Schistosoma mansoni hypothetical protein 0.0205 1 1
Trichomonas vaginalis heat shock protein, putative 0.0027 0.0687 0.1304
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0111 0.5067 0.8435
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0097 0.4372 0.4295
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Giardia lamblia Kinase, CMGC GSK 0.0055 0.2146 0.4748
Schistosoma mansoni tar DNA-binding protein 0.0068 0.2817 0.2719
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0021 0.0337 0.0479
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0111 0.5067 0.8837
Echinococcus granulosus tar DNA binding protein 0.0068 0.2817 0.2719
Echinococcus multilocularis chromobox protein 1 0.0072 0.3007 0.2912
Plasmodium vivax thioredoxin reductase, putative 0.0049 0.18 0.1965
Schistosoma mansoni tar DNA-binding protein 0.0068 0.2817 0.2719
Loa Loa (eye worm) endoplasmin 0.0047 0.1721 0.3431
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Trypanosoma cruzi heat shock protein 85, putative 0.004 0.1364 0.2903
Trypanosoma brucei heat shock protein 90, putative 0.0047 0.1721 0.3938
Brugia malayi intracellular kinase 0.0055 0.2146 0.4748
Echinococcus multilocularis chromobox protein 1 0.0072 0.3007 0.2912
Schistosoma mansoni heat shock protein 0.0031 0.0892 0.0768
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0337 0.0771
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0044 0.157 0.2572
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.18 0.393
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0337 0.0479
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0055 0.2146 0.2373
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0055 0.2146 0.2039
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0337 0.0771
Plasmodium falciparum glycogen synthase kinase 3 0.0055 0.2146 0.2373
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0337 0.0479
Trypanosoma cruzi DNA polymerase eta, putative 0.0021 0.0337 0.0479
Schistosoma mansoni heat shock protein 0.0047 0.1721 0.1609
Trichomonas vaginalis heat shock protein, putative 0.0044 0.157 0.3387
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Trypanosoma cruzi heat shock protein 90, putative 0.004 0.1364 0.2903
Schistosoma mansoni heat shock protein 0.0047 0.1721 0.1609
Echinococcus multilocularis heat shock protein 90 0.004 0.1364 0.1247
Trypanosoma brucei heat shock protein 84, putative 0.0031 0.0892 0.2041
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.4372 1
Trichomonas vaginalis endoplasmin, putative 0.0034 0.1044 0.2147
Loa Loa (eye worm) TAR-binding protein 0.0068 0.2817 0.6147
Echinococcus granulosus heat shock protein 0.0047 0.1721 0.1609
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0123 0.5716 1
Trichomonas vaginalis chromobox protein, putative 0.0043 0.1516 0.3262
Echinococcus granulosus chromobox protein 1 0.0072 0.3007 0.2912
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0111 0.5067 0.8837
Brugia malayi RNA recognition motif domain containing protein 0.0068 0.2817 0.6331
Loa Loa (eye worm) hypothetical protein 0.004 0.1357 0.2527
Entamoeba histolytica heat shock protein 90, putative 0.0047 0.1721 0.3431
Loa Loa (eye worm) heat shock protein 75 0.0031 0.0892 0.1375
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.4372 1
Trichomonas vaginalis CMGC family protein kinase 0.0055 0.2146 0.4748
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0021 0.0337 0.0206
Onchocerca volvulus Heterochromatin protein 1 homolog 0.004 0.1357 0.1335
Plasmodium vivax heat shock protein, putative 0.0178 0.8615 1
Trichomonas vaginalis chromobox protein, putative 0.0072 0.3007 0.6781
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Echinococcus granulosus dna polymerase eta 0.0021 0.0337 0.0206
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0021 0.0337 0.0206
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0055 0.2146 0.4748
Toxoplasma gondii Hsp90 domain-containing protein 0.0178 0.8615 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0097 0.4372 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0049 0.18 0.1689
Schistosoma mansoni DNA polymerase eta 0.0021 0.0337 0.0206
Trypanosoma brucei heat shock protein, putative 0.0047 0.1721 0.3938
Echinococcus granulosus endoplasmin 0.0044 0.157 0.1455
Brugia malayi Heterochromatin protein 1 0.0072 0.3007 0.6781
Giardia lamblia DINP protein human, muc B family 0.0021 0.0337 0.0479
Leishmania major heat shock protein 83-1 0.0047 0.1721 0.3746

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0041 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10.4179 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) 14.7157 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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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