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SMILES: [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)c(CO)c3CC[C@@]21[H]

InChI Key: InChIKey=SSIXFSQUOYPJTM-AFTVQHQSSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50471440   
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
Estrogen receptor beta


(Homo sapiens (Human))
BDBM50471440
PNG
(CHEMBL1627574)
Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)c(CO)c3CC[C@@]21[H]
Show InChI InChI=1S/C19H26O3/c1-19-9-8-13-11-4-6-17(21)15(10-20)12(11)2-3-14(13)16(19)5-7-18(19)22/h4,6,13-14,16,18,20-22H,2-3,5,7-10H2,1H3/t13-,14-,16+,18+,19+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 12n/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Induction of pS2 Gene expression in human MCF-7 cells


J Med Chem 40: 3756-64 (1997)


Article DOI: 10.1021/jm9701684
BindingDB Entry DOI: 10.7270/Q2280B95
More data for this
Ligand-Target Pair
Estrogen receptor beta


(Homo sapiens (Human))
BDBM50471440
PNG
(CHEMBL1627574)
Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)c(CO)c3CC[C@@]21[H]
Show InChI InChI=1S/C19H26O3/c1-19-9-8-13-11-4-6-17(21)15(10-20)12(11)2-3-14(13)16(19)5-7-18(19)22/h4,6,13-14,16,18,20-22H,2-3,5,7-10H2,1H3/t13-,14-,16+,18+,19+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 364n/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Affinity for estrogen receptor of human MCF-7 cells


J Med Chem 40: 3756-64 (1997)


Article DOI: 10.1021/jm9701684
BindingDB Entry DOI: 10.7270/Q2280B95
More data for this
Ligand-Target Pair