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PubMed code 11141112

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Estrogen receptor


(Homo sapiens (Human))
BDBM50250229
PNG
(2-(2,4-dihydroxyphenyl)-3-formyl-4-hydroxy-6-metho...)
Show SMILES COc1cc(O)c2c(C=O)c(oc2c1)-c1ccc(O)cc1O
Show InChI InChI=1S/C16H12O6/c1-21-9-5-13(20)15-11(7-17)16(22-14(15)6-9)10-3-2-8(18)4-12(10)19/h2-7,18-20H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 43n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Displacement of [3H]estradiol from estrogen receptor (unknown origin)


J Nat Prod 63: 1672-4 (2001)


BindingDB Entry DOI: 10.7270/Q2SB45HH
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50250228
PNG
(2-(2,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-benzof...)
Show SMILES COc1cc2oc(cc2cc1O)-c1ccc(O)cc1O
Show InChI InChI=1S/C15H12O5/c1-19-15-7-13-8(4-12(15)18)5-14(20-13)10-3-2-9(16)6-11(10)17/h2-7,16-18H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 46n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Displacement of [3H]estradiol from estrogen receptor (unknown origin)


J Nat Prod 63: 1672-4 (2001)


BindingDB Entry DOI: 10.7270/Q2SB45HH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%