Detailed information for compound 1272752

Basic information

Technical information
  • TDR Targets ID: 1272752
  • Name: 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]- N-(2,2,2-trifluoroethyl)acetamide
  • MW: 316.279 | Formula: C13H15F3N4O2
  • H donors: 3 H acceptors: 3 LogP: 1.63 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCNc1nc2c(n1CC(=O)NCC(F)(F)F)cccc2
  • InChi: 1S/C13H15F3N4O2/c14-13(15,16)8-18-11(22)7-20-10-4-2-1-3-9(10)19-12(20)17-5-6-21/h1-4,21H,5-8H2,(H,17,19)(H,18,22)
  • InChiKey: LXHMJWPLIBKDMA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[2-(2-hydroxyethylamino)-1-benzimidazolyl]-N-(2,2,2-trifluoroethyl)acetamide
  • 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(2,2,2-trifluoroethyl)ethanamide
  • SMR000377339
  • T5236401
  • MLS000772705

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative 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
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, 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
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
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
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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
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
Onchocerca volvulus Cell death protein 3 homolog 0.003 0.0639 0.5511
Schistosoma mansoni wnt related 0.0013 0.0118 0.0118
Schistosoma mansoni hypothetical protein 0.007 0.1883 0.1883
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.1159 0.1288
Brugia malayi Wnt-2 protein precursor 0.0013 0.0118 0.0131
Loa Loa (eye worm) hypothetical protein 0.005 0.1265 0.1406
Echinococcus multilocularis protein Wnt 2 0.0013 0.0118 0.0118
Schistosoma mansoni voltage-gated potassium channel 0.001 0.0031 0.0031
Schistosoma mansoni thyroid hormone receptor 0.001 0.0014 0.0014
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0014 0.0014
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0014 0.0014
Schistosoma mansoni coup transcription factor 0.001 0.0014 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0014 0.0016
Brugia malayi steroid hormone receptor 0.001 0.0014 0.0016
Schistosoma mansoni nuclear hormone receptor 0.001 0.0014 0.0014
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0014 0.0014
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0014 0.0014
Echinococcus granulosus zinc finger transcription factor gli2 0.0301 0.8999 0.8999
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0047 0.1159 1
Echinococcus granulosus Niemann Pick C1 protein 0.0096 0.2668 0.2668
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0014 0.0016
Loa Loa (eye worm) hypothetical protein 0.0053 0.1359 0.151
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.007 0.1883 0.1883
Brugia malayi wnt family protein 0.0013 0.0118 0.0131
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.1159 0.1159
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.092 0.092
Echinococcus granulosus caspase 2 0.003 0.0639 0.0639
Schistosoma mansoni wnt related 0.0013 0.0118 0.0118
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0014 0.0014
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0041 0.098 0.1089
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0036 0.0818 0.0818
Brugia malayi mbt repeat family protein 0.0047 0.1159 0.1288
Schistosoma mansoni hypothetical protein 0.0062 0.1616 0.1616
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0014 0.0016
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0195 0.5732 0.637
Echinococcus multilocularis geminin 0.0334 1 1
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0096 0.2668 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0053 0.1359 0.1359
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0031 0.0672 0.0747
Schistosoma mansoni hypothetical protein 0.004 0.0934 0.0934
Schistosoma mansoni wnt related 0.0013 0.0118 0.0118
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0014 0.0014
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0014 0.0014
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0014 0.0014
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0062 0.1616 0.1616
Echinococcus multilocularis caspase 2 0.003 0.0639 0.0639
Echinococcus granulosus GPCR family 2 0.0062 0.1616 0.1616
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0036 0.0818 0.0818
Schistosoma mansoni patched 1 0.0041 0.098 0.098
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0053 0.1359 0.151
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0185 0.5418 0.5418
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1414 0.1414
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0014 0.0016
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0014 0.0016
Echinococcus granulosus histone acetyltransferase MYST2 0.0053 0.1359 0.1359
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0014 0.0016
Brugia malayi CHE-14 protein 0.0041 0.098 0.1089
Loa Loa (eye worm) MBCTL1 0.0053 0.1359 0.151
Onchocerca volvulus 0.0047 0.1159 1
Loa Loa (eye worm) RNA binding protein 0.0062 0.1634 0.1816
Echinococcus multilocularis protein Wnt 1 0.0013 0.0118 0.0118
Brugia malayi Cell death protein 3 precursor 0.003 0.0639 0.071
Loa Loa (eye worm) latrophilin receptor protein 2 0.0062 0.1616 0.1796
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0036 0.0818 0.0909
Schistosoma mansoni hypothetical protein 0.0062 0.1616 0.1616
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0014 0.0016
Loa Loa (eye worm) CWN-2 protein 0.0013 0.0118 0.0131
Echinococcus granulosus Protein Wnt-11b 0.0013 0.0118 0.0118
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0014 0.0014
Loa Loa (eye worm) TAR-binding protein 0.0062 0.1634 0.1816
Loa Loa (eye worm) hypothetical protein 0.0013 0.0118 0.0131
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0014 0.0014
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1414 0.1414
Echinococcus multilocularis voltage gated potassium channel 0.001 0.0031 0.0031
Echinococcus multilocularis expressed conserved protein 0.009 0.2488 0.2488
Brugia malayi Wnt-4 protein precursor 0.0013 0.0118 0.0131
Schistosoma mansoni thyroid hormone receptor 0.001 0.0014 0.0014
Echinococcus granulosus protein Wnt 1 0.0013 0.0118 0.0118
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0014 0.0014
Echinococcus multilocularis wingless type MMTV integration site family 0.0013 0.0118 0.0118
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0053 0.1359 0.1359
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0062 0.1616 0.1616
Brugia malayi Calcitonin receptor-like protein seb-1 0.0195 0.5732 0.637
Echinococcus granulosus FTZ F1 alpha 0.001 0.0014 0.0014
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0014 0.0014
Loa Loa (eye worm) Wnt2 protein 0.0013 0.0118 0.0131
Echinococcus granulosus tar DNA binding protein 0.0062 0.1634 0.1634
Brugia malayi hypothetical protein 0.003 0.0639 0.071
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0014 0.0016
Loa Loa (eye worm) hypothetical protein 0.0047 0.1159 0.1288
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.1159 0.1159
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1634 0.1634
Brugia malayi hypothetical protein 0.007 0.1883 0.2093
Loa Loa (eye worm) hypothetical protein 0.0013 0.0118 0.0131
Schistosoma mansoni hypothetical protein 0.004 0.0934 0.0934
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.3335 0.3706
Brugia malayi wnt family protein 0.0013 0.0118 0.0131
Echinococcus multilocularis protein patched 0.0041 0.098 0.098
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0014 0.0016
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0014 0.0014
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0062 0.1616 0.1796
Loa Loa (eye worm) wnt-4 protein 0.0013 0.0118 0.0131
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0195 0.5732 0.637
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0014 0.0014
Brugia malayi TAR-binding protein 0.0062 0.1634 0.1816
Schistosoma mansoni hypothetical protein 0.004 0.0934 0.0934
Schistosoma mansoni hypothetical protein 0.0133 0.3827 0.3827
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0014 0.0016
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0014 0.0014
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0014 0.0016
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0014 0.0014
Echinococcus multilocularis apoptotic protease activating factor 1 0.003 0.0639 0.0639
Echinococcus multilocularis WNT 0.0013 0.0118 0.0118
Echinococcus granulosus expressed conserved protein 0.009 0.2488 0.2488
Schistosoma mansoni hypothetical protein 0.004 0.0934 0.0934
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0014 0.0016
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.1159 0.1159
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1414 0.1414
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0014 0.0016
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0014 0.0016
Loa Loa (eye worm) hypothetical protein 0.0041 0.098 0.1089
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1414 0.1414
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0014 0.0014
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0014 0.0122
Loa Loa (eye worm) hypothetical protein 0.0013 0.0118 0.0131
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0062 0.1616 0.1796
Echinococcus multilocularis tar DNA binding protein 0.0062 0.1634 0.1634
Loa Loa (eye worm) hypothetical protein 0.0013 0.0118 0.0131
Schistosoma mansoni hypothetical protein 0.0062 0.1616 0.1616
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0014 0.0016
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0014 0.0122
Loa Loa (eye worm) hypothetical protein 0.003 0.0639 0.071
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.1159 0.1159
Brugia malayi nuclear receptor NHR-88 0.001 0.0014 0.0016
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.007 0.1883 0.1883
Brugia malayi RNA binding protein 0.0062 0.1634 0.1816
Loa Loa (eye worm) zinc finger protein 0.0301 0.8999 1
Schistosoma mansoni voltage-gated potassium channel 0.001 0.0031 0.0031
Schistosoma mansoni wnt related 0.0013 0.0118 0.0118
Loa Loa (eye worm) hypothetical protein 0.001 0.0031 0.0035
Echinococcus granulosus Protein Wnt-04 0.0013 0.0118 0.0118
Brugia malayi Zinc finger, C2H2 type family protein 0.0301 0.8999 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1634 0.1634
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0014 0.0016
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Brugia malayi Niemann-Pick C1 protein precursor 0.0096 0.2668 0.2964
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1414 0.1571
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Echinococcus granulosus Protein patched homolog 1 0.0041 0.098 0.098
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0014 0.0016
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.1634 0.1816
Loa Loa (eye worm) hypothetical protein 0.0133 0.3827 0.4253
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1634 0.1634
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0014 0.0014
Brugia malayi mbt repeat family protein 0.0047 0.1159 0.1288
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1414 0.1571
Echinococcus granulosus protein Wnt 2 0.0013 0.0118 0.0118
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0014 0.0016
Echinococcus multilocularis GPCR, family 2 0.0062 0.1616 0.1616
Echinococcus multilocularis WNT 0.0013 0.0118 0.0118
Brugia malayi MH2 domain containing protein 0.0118 0.3335 0.3706
Brugia malayi wnt family protein 0.0013 0.0118 0.0131
Schistosoma mansoni hypothetical protein 0.0062 0.1616 0.1616
Schistosoma mansoni wnt-5 0.0013 0.0118 0.0118
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0062 0.1616 0.1616
Echinococcus multilocularis sterol regulatory element binding protein 0.0041 0.098 0.098
Echinococcus multilocularis zinc finger transcription factor gli2 0.0301 0.8999 0.8999
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0014 0.0016
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0014 0.0016
Schistosoma mansoni hypothetical protein 0.0334 1 1
Schistosoma mansoni caspase-7 (C14 family) 0.003 0.0639 0.0639
Echinococcus granulosus Protein Wnt-5 0.0013 0.0118 0.0118
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0014 0.0014
Schistosoma mansoni transcription factor LCR-F1 0.007 0.1883 0.1883
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0016
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0014 0.0014
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1634 0.1634
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1414 0.1414
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.098 1
Brugia malayi wnt family protein 0.0013 0.0118 0.0131
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0014 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0014 0.0016
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0036 0.0818 0.0909
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0185 0.5418 0.5418
Brugia malayi ecdysteroid receptor 0.001 0.0014 0.0016
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0014 0.0016
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0014 0.0014
Echinococcus granulosus apoptotic protease activating factor 1 0.003 0.0639 0.0639
Loa Loa (eye worm) hypothetical protein 0.003 0.0639 0.071
Echinococcus granulosus sterol regulatory element binding protein 0.0041 0.098 0.098
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.1159 0.1159
Schistosoma mansoni tar DNA-binding protein 0.0062 0.1634 0.1634
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.1634 0.1816
Echinococcus multilocularis Niemann Pick C1 protein 0.0137 0.3937 0.3937
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0062 0.1616 0.1616
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0014 0.0014
Schistosoma mansoni hypothetical protein 0.003 0.0639 0.0639
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1414 0.1414
Schistosoma mansoni hypothetical protein 0.0024 0.0444 0.0444
Brugia malayi Latrophilin receptor protein 2 0.0062 0.1616 0.1796
Onchocerca volvulus 0.003 0.0639 0.5511
Loa Loa (eye worm) hypothetical protein 0.0195 0.5732 0.637
Brugia malayi latrophilin 2 splice variant baaae 0.0133 0.3827 0.4253
Loa Loa (eye worm) hypothetical protein 0.0096 0.2668 0.2964
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0014 0.0122
Schistosoma mansoni hypothetical protein 0.0334 1 1
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0097 0.2713 0.2713
Brugia malayi nuclear hormone receptor 0.001 0.0014 0.0016
Echinococcus granulosus potassium voltage gated channel subfamily H 0.001 0.0031 0.0031
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0014 0.0016
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.001 0.0031 0.0031
Echinococcus granulosus Niemann Pick C1 protein 0.0137 0.3937 0.3937
Onchocerca volvulus 0.001 0.0014 0.0122
Echinococcus granulosus voltage gated potassium channel 0.001 0.0031 0.0031
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.001 0.0031 0.0035
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1414 0.1414
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0053 0.1359 0.1359
Schistosoma mansoni hypothetical protein 0.0285 0.8514 0.8514
Echinococcus granulosus Protein Wnt-111 0.0013 0.0118 0.0118
Echinococcus multilocularis protein dispatched 1 0.0047 0.1159 0.1159
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.092 0.092
Echinococcus multilocularis histone acetyltransferase MYST2 0.0053 0.1359 0.1359
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0014 0.0016
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.1159 0.1159
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.3335 0.3706
Loa Loa (eye worm) hypothetical protein 0.0013 0.0118 0.0131
Echinococcus multilocularis wnt family member wnt11 2 0.0013 0.0118 0.0118
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.1159 0.1159
Echinococcus multilocularis Niemann Pick C1 protein 0.0096 0.2668 0.2668

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 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) = 89.1251 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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

No literature references available for this target.

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