Detailed information for compound 411860

Basic information

Technical information
  • TDR Targets ID: 411860
  • Name: N-[4-[[(2R)-4-(dimethylamino)-1-phenylsulfany lbutan-2-yl]amino]-3-nitrophenyl]sulfonyl-4-[ 4-(pyridin-2-ylmethylidene)piperidin-1-yl]ben zamide
  • MW: 700.87 | Formula: C36H40N6O5S2
  • H donors: 2 H acceptors: 6 LogP: 6.71 Rotable bonds: 15
    Rule of 5 violations (Lipinski): 2
  • SMILES: CN(CC[C@@H](Nc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NC(=O)c1ccc(cc1)N1CC/C(=C/c2ccccn2)/CC1)CSc1ccccc1)C
  • InChi: 1S/C36H40N6O5S2/c1-40(2)21-19-30(26-48-32-9-4-3-5-10-32)38-34-16-15-33(25-35(34)42(44)45)49(46,47)39-36(43)28-11-13-31(14-12-28)41-22-17-27(18-23-41)24-29-8-6-7-20-37-29/h3-16,20,24-25,30,38H,17-19,21-23,26H2,1-2H3,(H,39,43)/t30-/m1/s1
  • InChiKey: AXRKKWXXRAOBEV-SSEXGKCCSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[4-[[(1R)-3-(dimethylamino)-1-(phenylsulfanylmethyl)propyl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(2-pyridylmethylene)-1-piperidyl]benzamide
  • N-[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl-4-[4-(2-pyridylmethylene)-1-piperidinyl]benzamide
  • N-[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanyl-butan-2-yl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(pyridin-2-ylmethylidene)piperidin-1-yl]benzamide
  • N-[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(2-pyridylmethylene)piperidino]benzamide
  • N-[4-[[(2R)-4-dimethylamino-1-phenylsulfanylbutan-2-yl]amino]-3-nitrophenyl]sulfonyl-4-[4-(pyridin-2-ylmethylidene)piperidin-1-yl]benzamide
  • N-[4-[[(1R)-3-dimethylamino-1-(phenylsulfanylmethyl)propyl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(2-pyridylmethylene)-1-piperidyl]benzamide
  • N-[4-[[(1R)-3-dimethylamino-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl-4-[4-(2-pyridylmethylene)-1-piperidinyl]benzamide
  • N-[4-[[(1R)-3-dimethylamino-1-[(phenylthio)methyl]propyl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(2-pyridylmethylene)-1-piperidyl]benzamide
  • N-[4-[[(2R)-4-dimethylamino-1-phenylsulfanyl-butan-2-yl]amino]-3-nitro-phenyl]sulfonyl-4-[4-(pyridin-2-ylmethylidene)piperidin-1-yl]benzamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens BCL2-like 1 Starlite/ChEMBL References
Homo sapiens B-cell CLL/lymphoma 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis EGFP:Bcl2 fusion protein Get druggable targets OG5_139665 All targets in OG5_139665
Echinococcus granulosus EGFP:Bcl2 fusion protein Get druggable targets OG5_139665 All targets in OG5_139665
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
Brugia malayi nuclear receptor NHR-67 0.0048 0.0173 0.023
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0159 0.021
Brugia malayi hypothetical protein 0.0048 0.0173 0.023
Trypanosoma brucei DNA polymerase eta, putative 0.0045 0.0152 0.02
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0159 0.021
Loa Loa (eye worm) steroid hormone receptor 0.0102 0.0557 0.0775
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Brugia malayi Nuclear hormone receptor-like 1 0.0054 0.0214 0.0288
Brugia malayi Nuclear hormone receptor E75 0.0048 0.0173 0.023
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0102 0.0557 0.0775
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi Steroid receptor seven-up type 2 0.0102 0.0557 0.0775
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1014 0.7044 1
Schistosoma mansoni apoptosis regulator bax 0.0067 0.0305 0.0305
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Schistosoma mansoni DNA polymerase eta 0.0045 0.0152 0.0152
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0159 0.0142
Trypanosoma cruzi DNA polymerase eta, putative 0.0032 0.0057 0.0064
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0018 0.0009
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0102 0.0557 0.0557
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0102 0.0557 0.0557
Brugia malayi Nuclear hormone receptor-like 1 0.0102 0.0557 0.0775
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.1376 0.9616 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.1014 0.7044 0.7044
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0048 0.0173 0.0162
Loa Loa (eye worm) hypothetical protein 0.0054 0.0214 0.0288
Onchocerca volvulus Bile acid receptor homolog 0.0102 0.0557 1
Brugia malayi RNA binding protein 0.0064 0.0286 0.039
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0067 0.0305 0.0299
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0286 0.0286
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0102 0.0557 0.0775
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0048 0.0173 0.023
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0102 0.0557 0.0775
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0102 0.0557 0.054
Leishmania major DNA polymerase eta, putative 0.0045 0.0152 0.02
Brugia malayi hypothetical protein 0.0054 0.0214 0.0288
Loa Loa (eye worm) hypothetical protein 0.0054 0.0214 0.0288
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0286 0.0286
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Schistosoma mansoni nuclear receptor 0.0048 0.0173 0.0173
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0102 0.0557 0.0775
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0067 0.0305 0.0305
Onchocerca volvulus 0.0102 0.0557 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0102 0.0557 0.0775
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0102 0.0557 0.0562
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0054 0.0214 0.0197
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi steroid hormone receptor 0.0102 0.0557 0.0775
Brugia malayi TAR-binding protein 0.0064 0.0286 0.039
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0102 0.0557 0.0562
Echinococcus granulosus tar DNA binding protein 0.0064 0.0286 0.0268
Entamoeba histolytica hypothetical protein 0.0036 0.0089 0.0102
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0089 0.0071
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0835 0.5769 0.5991
Echinococcus multilocularis thyroid hormone receptor alpha 0.0102 0.0557 0.0562
Brugia malayi ecdysteroid receptor 0.0102 0.0557 0.0775
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0102 0.0557 0.054
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0048 0.0173 0.0156
Plasmodium falciparum flap endonuclease 1 0.0026 0.0018 1
Schistosoma mansoni nuclear hormone receptor 0.0048 0.0173 0.0173
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Brugia malayi ImpB/MucB/SamB family protein 0.0045 0.0152 0.02
Schistosoma mansoni nuclear hormone receptor 0.0102 0.0557 0.0557
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0054 0.0214 0.0288
Brugia malayi conserved hypotetical protein 0.0048 0.0173 0.023
Echinococcus granulosus nuclear receptor nhr 48 0.0048 0.0173 0.0156
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.0152 0.02
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0102 0.0557 0.0775
Schistosoma mansoni coup transcription factor 0.0102 0.0557 0.0557
Echinococcus granulosus dna polymerase eta 0.0045 0.0152 0.0135
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi orphan nuclear receptor NR2E1 0.0048 0.0173 0.023
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.1014 0.7044 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0048 0.0173 0.0156
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0102 0.0557 0.054
Brugia malayi nuclear hormone receptor 0.0048 0.0173 0.023
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0286 0.0286
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0102 0.0557 0.0775
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0286 0.039
Brugia malayi nuclear receptor NHR-88 0.0102 0.0557 0.0775
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi Nuclear hormone receptor E75 0.0048 0.0173 0.023
Entamoeba histolytica hypothetical protein 0.0036 0.0089 0.0102
Loa Loa (eye worm) hypothetical protein 0.0067 0.0305 0.0417
Brugia malayi nuclear hormone receptor 0.0102 0.0557 0.0775
Brugia malayi hypothetical protein 0.0054 0.0214 0.0288
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0018 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0102 0.0557 0.0557
Giardia lamblia Flap structure-specific endonuclease 0.0026 0.0018 0.5
Schistosoma mansoni hypothetical protein 0.0067 0.0305 0.0305
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0102 0.0557 0.054
Brugia malayi ecdysone receptor 0.0048 0.0173 0.023
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0054 0.0214 0.0214
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0102 0.0557 0.0775
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0018 0.0009
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0286 0.0279
Brugia malayi photoreceptor-specific nuclear receptor 0.0102 0.0557 0.0775
Loa Loa (eye worm) RNA binding protein 0.0064 0.0286 0.039
Schistosoma mansoni nuclear receptor nhr-48 0.0048 0.0173 0.0173
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.1014 0.7044 1
Echinococcus multilocularis nuclear receptor nhr 48 0.0048 0.0173 0.0162
Echinococcus multilocularis geminin 0.0171 0.1048 0.1073
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0159 0.0147
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0159 0.0159
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0159 0.0142
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0102 0.0557 0.0775
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0102 0.0557 0.054
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0067 0.0305 0.0288
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0102 0.0557 0.0562
Brugia malayi Flap endonuclease-1 0.0026 0.0018 0.0009
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0089 0.0089
Onchocerca volvulus Protein ultraspiracle homolog 0.0102 0.0557 1
Entamoeba histolytica hypothetical protein 0.0036 0.0089 0.0102
Leishmania major DNA polymerase eta, putative 0.0032 0.0057 0.0064
Brugia malayi nuclear hormone receptor family member nhr-6 0.0048 0.0173 0.023
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0048 0.0173 0.0173
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0102 0.0557 0.0775
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.1014 0.7044 0.732
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0102 0.0557 0.0775
Brugia malayi hypothetical protein 0.0048 0.0173 0.023
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0018 0.0009
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0048 0.0173 0.0173
Brugia malayi tailless protein 0.0048 0.0173 0.023
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0018 0.0009
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0102 0.0557 0.0557
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Brugia malayi hypothetical protein 0.0036 0.0089 0.011
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0054 0.0214 0.0214
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0102 0.0557 0.0775
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0048 0.0173 0.0162
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0286 0.0286
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0159 0.0159
Echinococcus granulosus geminin 0.0171 0.1048 0.1032
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0102 0.0557 0.0557
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.1014 0.7044 0.7039
Schistosoma mansoni steroid hormone receptor ad4bp 0.0102 0.0557 0.0557
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0102 0.0557 0.0562
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0048 0.0173 0.0162
Echinococcus granulosus FTZ F1 alpha 0.0102 0.0557 0.054
Schistosoma mansoni nuclear receptor 0.0048 0.0173 0.0173
Brugia malayi nuclear receptor RXR 0.0048 0.0173 0.023
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0102 0.0557 0.0775
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0018 1
Schistosoma mansoni retinoic acid receptor RXR 0.143 1 1
Echinococcus granulosus thyroid hormone receptor alpha 0.0048 0.0173 0.0156
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0048 0.0173 0.023
Loa Loa (eye worm) hypothetical protein 0.0054 0.0214 0.0288
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0159 0.0159
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1014 0.7044 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0102 0.0557 0.0775
Loa Loa (eye worm) apoptosis regulator protein 0.0067 0.0305 0.0417
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0102 0.0557 0.0775
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0102 0.0557 1
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0048 0.0173 0.0156
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0159 0.0147
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0102 0.0557 0.0557
Loa Loa (eye worm) DR-78 0.0048 0.0173 0.023
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Schistosoma mansoni hypothetical protein 0.0036 0.0089 0.0089
Echinococcus granulosus Nuclear hormone receptor HR96 0.0048 0.0173 0.0156
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0835 0.5769 0.5761
Echinococcus multilocularis dna polymerase eta 0.0045 0.0152 0.014
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0286 0.039
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0102 0.0557 0.0775
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0018 0.1335
Loa Loa (eye worm) nuclear receptor NHR-67 0.0048 0.0173 0.023
Schistosoma mansoni hypothetical protein 0.0067 0.0305 0.0305
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0102 0.0557 0.0775
Loa Loa (eye worm) nuclear hormone receptor 0.0048 0.0173 0.023
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0102 0.0557 0.0775
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0102 0.0557 0.0562
Loa Loa (eye worm) hypothetical protein 0.0054 0.0214 0.0288
Schistosoma mansoni thyroid hormone receptor 0.0102 0.0557 0.0557
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0054 0.0214 0.0205
Schistosoma mansoni zinc finger protein 0.0048 0.0173 0.0173
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1014 0.7044 1
Loa Loa (eye worm) hypothetical protein 0.0102 0.0557 0.0775
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0089 0.0074
Brugia malayi nuclear receptor RXR 0.0054 0.0214 0.0288
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.1014 0.7044 1
Schistosoma mansoni hypothetical protein 0.0171 0.1048 0.1048
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0286 0.039
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Brugia malayi Nuclear hormone receptor-like 1 0.0054 0.0214 0.0288
Loa Loa (eye worm) hypothetical protein 0.0054 0.0214 0.0288
Echinococcus multilocularis transcription factor Dp 1 0.0587 0.4006 0.4155
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0102 0.0557 0.0557
Echinococcus granulosus ecdysone induced protein 78C 0.0102 0.0557 0.054
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0067 0.0305 0.0417
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0102 0.0557 0.054
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0286 0.0286
Echinococcus multilocularis ecdysone induced protein 78C 0.0102 0.0557 0.0562
Loa Loa (eye worm) hypothetical protein 0.0045 0.0152 0.02
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0102 0.0557 0.0775
Schistosoma mansoni hypothetical protein 0.0067 0.0305 0.0305
Loa Loa (eye worm) hypothetical protein 0.0048 0.0173 0.023
Schistosoma mansoni thyroid hormone receptor 0.0102 0.0557 0.0557
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0102 0.0557 0.0562
Schistosoma mansoni hypothetical protein 0.0171 0.1048 0.1048
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0048 0.0173 0.0162
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0032 0.0057 1
Echinococcus granulosus transcription factor Dp 1 0.0587 0.4006 0.3995
Brugia malayi nuclear hormone receptor family member odr-7 0.0048 0.0173 0.023
Entamoeba histolytica hypothetical protein 0.0036 0.0089 0.0102
Schistosoma mansoni nuclear hormone receptor 0.0048 0.0173 0.0173
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0102 0.0557 0.0775
Brugia malayi nuclear receptor NHR-88 0.0048 0.0173 0.023
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.1014 0.7044 1
Echinococcus multilocularis FTZ F1 alpha 0.0102 0.0557 0.0562

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.55 uM Reversal of cytokine withdrawal protection in IL3 dependent Bcl-xL overexpressing mouse FL5.12 cells ChEMBL. 17256834
EC50 (functional) = 0.55 uM Reversal of cytokine withdrawal protection in IL3 dependent Bcl-xL overexpressing mouse FL5.12 cells ChEMBL. 17256834
EC50 (functional) = 1.38 uM Reversal of cytokine withdrawal protection in IL3 dependent Bcl2 overexpressing mouse FL5.12 cells ChEMBL. 17256834
EC50 (functional) = 1.38 uM Reversal of cytokine withdrawal protection in IL3 dependent Bcl2 overexpressing mouse FL5.12 cells ChEMBL. 17256834
IC50 (binding) = 700 nM Displacement of Bad-derived peptide from Bcl-xL by FPA in presence of 10% human serum ChEMBL. 17256834
IC50 (binding) = 700 nM Displacement of Bad-derived peptide from Bcl-xL by FPA in presence of 10% human serum ChEMBL. 17256834
Ki (binding) = 3.6 nM Displacement of Bad-derived peptide from Bcl-xL by fluorescence polarization assay ChEMBL. 17256834
Ki (binding) = 3.6 nM Displacement of Bad-derived peptide from Bcl-xL by fluorescence polarization assay ChEMBL. 17256834
Ki (binding) = 46 nM Displacement of Bax-derived peptide from Bcl2 by fluorescence polarization assay ChEMBL. 17256834
Ki (binding) = 46 nM Displacement of Bax-derived peptide from Bcl2 by fluorescence polarization assay ChEMBL. 17256834

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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