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BDBM50159323 3,5-Dichloro-4-{(4S,5R)-5-[2-chloro-4-(2-piperidin-1-yl-ethoxy)-phenyl]-4,5-dihydro-1H-imidazol-4-yl}-phenol::CHEMBL365779

SMILES: Oc1cc(Cl)c([C@@H]2N=CN[C@@H]2c2ccc(OCCN3CCCCC3)cc2Cl)c(Cl)c1

InChI Key: InChIKey=IOMUFHNCTKDSQD-YADHBBJMSA-N

Data: 2 EC50

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 = 50159323   
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


(Homo sapiens (Human))
BDBM50159323
PNG
(3,5-Dichloro-4-{(4S,5R)-5-[2-chloro-4-(2-piperidin...)
Show SMILES Oc1cc(Cl)c([C@@H]2N=CN[C@@H]2c2ccc(OCCN3CCCCC3)cc2Cl)c(Cl)c1 |c:7|
Show InChI InChI=1S/C22H24Cl3N3O2/c23-17-12-15(30-9-8-28-6-2-1-3-7-28)4-5-16(17)21-22(27-13-26-21)20-18(24)10-14(29)11-19(20)25/h4-5,10-13,21-22,29H,1-3,6-9H2,(H,26,27)/t21-,22+/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 85n/an/an/an/a



Free University of Berlin

Curated by ChEMBL


Assay Description
Effective concentration against estrogen receptor alpha of MCF-7-2a cells


J Med Chem 48: 466-74 (2005)


Article DOI: 10.1021/jm040855c
BindingDB Entry DOI: 10.7270/Q20864T2
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50159323
PNG
(3,5-Dichloro-4-{(4S,5R)-5-[2-chloro-4-(2-piperidin...)
Show SMILES Oc1cc(Cl)c([C@@H]2N=CN[C@@H]2c2ccc(OCCN3CCCCC3)cc2Cl)c(Cl)c1 |c:7|
Show InChI InChI=1S/C22H24Cl3N3O2/c23-17-12-15(30-9-8-28-6-2-1-3-7-28)4-5-16(17)21-22(27-13-26-21)20-18(24)10-14(29)11-19(20)25/h4-5,10-13,21-22,29H,1-3,6-9H2,(H,26,27)/t21-,22+/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 400n/an/an/an/a



Free University of Berlin

Curated by ChEMBL


Assay Description
Effective concentration against estrogen receptor beta of MCF-7-2a cells


J Med Chem 48: 466-74 (2005)


Article DOI: 10.1021/jm040855c
BindingDB Entry DOI: 10.7270/Q20864T2
More data for this
Ligand-Target Pair