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BDBM50484946 (18F)AV-45::18F-AV-45::AV-45 F-18::Amyvid::CHEBI:66880::FLORBETAPIR F 18::Florbetapir (18f)::Florbetapir F 18

SMILES: CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1

InChI Key: InChIKey=YNDIAUKFXKEXSV-NSCUHMNNSA-N

Data: 5 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50484946   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50484946
PNG
((18F)AV-45 | 18F-AV-45 | AV-45 F-18 | Amyvid | CHE...)
Show SMILES CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1
Show InChI InChI=1S/C20H25FN2O3/c1-22-19-7-4-17(5-8-19)2-3-18-6-9-20(23-16-18)26-15-14-25-13-12-24-11-10-21/h2-9,16,22H,10-15H2,1H3/b3-2+
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2.90n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Binding affinity to human amyloid beta plaque


ACS Med Chem Lett 3: 265-7 (2012)


Article DOI: 10.1021/ml300058m
BindingDB Entry DOI: 10.7270/Q2FR00HZ
More data for this
Ligand-Target Pair
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50484946
PNG
((18F)AV-45 | 18F-AV-45 | AV-45 F-18 | Amyvid | CHE...)
Show SMILES CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1
Show InChI InChI=1S/C20H25FN2O3/c1-22-19-7-4-17(5-8-19)2-3-18-6-9-20(23-16-18)26-15-14-25-13-12-24-11-10-21/h2-9,16,22H,10-15H2,1H3/b3-2+
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2.90n/an/an/an/an/an/an/an/a



Technische Universit£t M£nchen

Curated by ChEMBL


Assay Description
Binding affinity to amyloid beta aggregates in postmortem human Alzheimer's disease brain homogenates after 2 hrs by gamma counting


ACS Med Chem Lett 2: 673-7 (2011)


Article DOI: 10.1021/ml200123w
BindingDB Entry DOI: 10.7270/Q29889V4
More data for this
Ligand-Target Pair
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50484946
PNG
((18F)AV-45 | 18F-AV-45 | AV-45 F-18 | Amyvid | CHE...)
Show SMILES CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1
Show InChI InChI=1S/C20H25FN2O3/c1-22-19-7-4-17(5-8-19)2-3-18-6-9-20(23-16-18)26-15-14-25-13-12-24-11-10-21/h2-9,16,22H,10-15H2,1H3/b3-2+
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2.90n/an/an/an/an/an/an/an/a



Sungkyunkwan University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity to amyloid beta (1-42) aggregates in human Alzheimer's disease brain sections


J Med Chem 55: 883-92 (2012)


Article DOI: 10.1021/jm201400q
BindingDB Entry DOI: 10.7270/Q2X92F5G
More data for this
Ligand-Target Pair
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50484946
PNG
((18F)AV-45 | 18F-AV-45 | AV-45 F-18 | Amyvid | CHE...)
Show SMILES CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1
Show InChI InChI=1S/C20H25FN2O3/c1-22-19-7-4-17(5-8-19)2-3-18-6-9-20(23-16-18)26-15-14-25-13-12-24-11-10-21/h2-9,16,22H,10-15H2,1H3/b3-2+
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2.90n/an/an/an/an/an/an/an/a



Beijing Normal University

Curated by ChEMBL


Assay Description
Displacement of [125I]IMPY from amyloid beta in brain homogenate of Alzheimer's disease patient after 2 hrs by gamma counting analysis


Bioorg Med Chem 21: 3708-14 (2013)


Article DOI: 10.1016/j.bmc.2013.04.028
BindingDB Entry DOI: 10.7270/Q22J6FSQ
More data for this
Ligand-Target Pair
Beta amyloid A4 protein


(Homo sapiens (Human))
BDBM50484946
PNG
((18F)AV-45 | 18F-AV-45 | AV-45 F-18 | Amyvid | CHE...)
Show SMILES CNc1ccc(\C=C\c2ccc(OCCOCCOCC[18F])nc2)cc1
Show InChI InChI=1S/C20H25FN2O3/c1-22-19-7-4-17(5-8-19)2-3-18-6-9-20(23-16-18)26-15-14-25-13-12-24-11-10-21/h2-9,16,22H,10-15H2,1H3/b3-2+
PDB
MMDB

Reactome pathway
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PC sid
UniChem
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2.90n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Displacement of [18F]-amyvid from amyloid-beta aggregates in alzheimer's disease patient brain homogenates after 1 hr


J Med Chem 54: 8085-98 (2011)


Article DOI: 10.1021/jm2009106
BindingDB Entry DOI: 10.7270/Q26976FJ
More data for this
Ligand-Target Pair