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BDBM87264 1-[3-(3-methylbut-2-enyl)-4-oxidanyl-phenyl]propan-1-one::1-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-1-propanone::1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-1-propanone::1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propan-1-one::MLS000541220::SMR000162130::cid_902152

SMILES: [#6]-[#6]-[#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1

InChI Key: InChIKey=UVROICCSQKWCTF-UHFFFAOYSA-N

Data: 3 IC50

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 = 87264   
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
Alpha trans-inducing protein (VP16)


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM87264
PNG
(1-[3-(3-methylbut-2-enyl)-4-oxidanyl-phenyl]propan...)
Show SMILES [#6]-[#6]-[#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1
Show InChI InChI=1S/C14H18O2/c1-4-13(15)11-7-8-14(16)12(9-11)6-5-10(2)3/h5,7-9,16H,4,6H2,1-3H3
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.84E+3n/an/an/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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2D21W6V
More data for this
Ligand-Target Pair
nuclear receptor coactivator 3 isoform a


(Homo sapiens (Human))
BDBM87264
PNG
(1-[3-(3-methylbut-2-enyl)-4-oxidanyl-phenyl]propan...)
Show SMILES [#6]-[#6]-[#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1
Show InChI InChI=1S/C14H18O2/c1-4-13(15)11-7-8-14(16)12(9-11)6-5-10(2)3/h5,7-9,16H,4,6H2,1-3H3
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antibodypedia
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UniChem

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PCBioAssay
n/an/a 8.77E+3n/an/an/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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2HT2MXV
More data for this
Ligand-Target Pair
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM87264
PNG
(1-[3-(3-methylbut-2-enyl)-4-oxidanyl-phenyl]propan...)
Show SMILES [#6]-[#6]-[#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1
Show InChI InChI=1S/C14H18O2/c1-4-13(15)11-7-8-14(16)12(9-11)6-5-10(2)3/h5,7-9,16H,4,6H2,1-3H3
PDB
MMDB

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antibodypedia
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PC cid
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UniChem

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PCBioAssay
n/an/a 1.16E+4n/an/an/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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q28914F2
More data for this
Ligand-Target Pair