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BDBM61779 2-benzyl-4-[(dimethylamino)methyl]-1-benzofuran-5-ol::2-benzyl-4-[(dimethylamino)methyl]benzofuran-5-ol::4-[(dimethylamino)methyl]-2-(phenylmethyl)-1-benzofuran-5-ol::4-[(dimethylamino)methyl]-2-(phenylmethyl)-5-benzofuranol::MLS000039159::SMR000034428::cid_657581

SMILES: CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12

InChI Key: InChIKey=IIHQWGVGNVVDIB-UHFFFAOYSA-N

Data: 1 IC50  2 EC50

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 3 hits for monomerid = 61779   
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
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM61779
PNG
(2-benzyl-4-[(dimethylamino)methyl]-1-benzofuran-5-...)
Show SMILES CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12
Show InChI InChI=1S/C18H19NO2/c1-19(2)12-16-15-11-14(10-13-6-4-3-5-7-13)21-18(15)9-8-17(16)20/h3-9,11,20H,10,12H2,1-2H3
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.47E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29P302B
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM61779
PNG
(2-benzyl-4-[(dimethylamino)methyl]-1-benzofuran-5-...)
Show SMILES CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12
Show InChI InChI=1S/C18H19NO2/c1-19(2)12-16-15-11-14(10-13-6-4-3-5-7-13)21-18(15)9-8-17(16)20/h3-9,11,20H,10,12H2,1-2H3
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antibodypedia
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UniChem
Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



CNRS/Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of Akt/mTOR in human 786-O cells assessed as inhibition of nuclear export of transcription factor FOXO1a


Eur J Med Chem 74: 41-9 (2014)


Article DOI: 10.1016/j.ejmech.2013.12.020
BindingDB Entry DOI: 10.7270/Q2S75K8P
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM61779
PNG
(2-benzyl-4-[(dimethylamino)methyl]-1-benzofuran-5-...)
Show SMILES CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12
Show InChI InChI=1S/C18H19NO2/c1-19(2)12-16-15-11-14(10-13-6-4-3-5-7-13)21-18(15)9-8-17(16)20/h3-9,11,20H,10,12H2,1-2H3
PDB

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.54E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28P5XX5
More data for this
Ligand-Target Pair