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BDBM50167733 10-[4-(2-Piperidin-1-yl-ethoxy)-benzyl]-10H-benzo[4,5]thieno[3,2-b]indol-7-ol::CHEMBL363412

SMILES: Oc1ccc2c(c1)sc1c3ccccc3n(Cc3ccc(OCCN4CCCCC4)cc3)c21

InChI Key: InChIKey=QOZYJHACMJBAJT-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50167733   
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
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50167733
PNG
(10-[4-(2-Piperidin-1-yl-ethoxy)-benzyl]-10H-benzo[...)
Show SMILES Oc1ccc2c(c1)sc1c3ccccc3n(Cc3ccc(OCCN4CCCCC4)cc3)c21
Show InChI InChI=1S/C28H28N2O2S/c31-21-10-13-24-26(18-21)33-28-23-6-2-3-7-25(23)30(27(24)28)19-20-8-11-22(12-9-20)32-17-16-29-14-4-1-5-15-29/h2-3,6-13,18,31H,1,4-5,14-17,19H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of [3H]-17-beta-estradiol binding to human estrogen receptor beta


Bioorg Med Chem Lett 15: 2891-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.111
BindingDB Entry DOI: 10.7270/Q2JW8DDX
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50167733
PNG
(10-[4-(2-Piperidin-1-yl-ethoxy)-benzyl]-10H-benzo[...)
Show SMILES Oc1ccc2c(c1)sc1c3ccccc3n(Cc3ccc(OCCN4CCCCC4)cc3)c21
Show InChI InChI=1S/C28H28N2O2S/c31-21-10-13-24-26(18-21)33-28-23-6-2-3-7-25(23)30(27(24)28)19-20-8-11-22(12-9-20)32-17-16-29-14-4-1-5-15-29/h2-3,6-13,18,31H,1,4-5,14-17,19H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 39n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibitino of [3H]-17-beta-estradiol binding to human estrogen receptor alpha


Bioorg Med Chem Lett 15: 2891-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.111
BindingDB Entry DOI: 10.7270/Q2JW8DDX
More data for this
Ligand-Target Pair