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SMILES: CCCCCCCc1ccc(cc1)C(=O)C=CC

InChI Key: InChIKey=LCSOCUYXJADQCV-UHFFFAOYSA-N

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 2 hits for monomerid = 18827   
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
Thyroid hormone receptor beta [209-461]


(Homo sapiens (Human))
BDBM18827
PNG
((2E)-1-(4-heptylphenyl)but-2-en-1-one | Enone, 4b)
Show SMILES CCCCCCCc1ccc(cc1)C(=O)C=CC |w:16.17|
Show InChI InChI=1S/C17H24O/c1-3-5-6-7-8-10-15-11-13-16(14-12-15)17(18)9-4-2/h4,9,11-14H,3,5-8,10H2,1-2H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.60E+3n/an/an/an/an/an/a



St. Jude Research Hospital



Assay Description
IC50 is the concentration of each compound required to inhibit 50% of the binding between the TR LBD and the SRC2-2 peptide using fluorescence polari...


J Med Chem 50: 5269-5280 (2007)


Article DOI: 10.1021/jm070556y
BindingDB Entry DOI: 10.7270/Q24B2ZK8
More data for this
Ligand-Target Pair
Thyroid hormone receptor alpha [148-410]


(Homo sapiens (Human))
BDBM18827
PNG
((2E)-1-(4-heptylphenyl)but-2-en-1-one | Enone, 4b)
Show SMILES CCCCCCCc1ccc(cc1)C(=O)C=CC |w:16.17|
Show InChI InChI=1S/C17H24O/c1-3-5-6-7-8-10-15-11-13-16(14-12-15)17(18)9-4-2/h4,9,11-14H,3,5-8,10H2,1-2H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.89E+4n/an/an/an/a7.222



St. Jude Research Hospital



Assay Description
IC50 is the concentration of each compound required to inhibit 50% of the binding between the TR LBD and the SRC2-2 peptide using fluorescence polari...


J Med Chem 50: 5269-5280 (2007)


Article DOI: 10.1021/jm070556y
BindingDB Entry DOI: 10.7270/Q24B2ZK8
More data for this
Ligand-Target Pair