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SMILES: CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3ccccc3n2Cc2ccccc2)C(=O)CC(C)C1

InChI Key: InChIKey=SSFLUOVTMGWFMW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50454052   
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))		BDBM50454052
PNG
(CHEMBL4206393)
Show SMILES CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3ccccc3n2Cc2ccccc2)C(=O)CC(C)C1 |c:5,10|
Show InChI InChI=1S/C30H29NO3/c1-18-12-24(32)29-26(14-18)34-27-15-19(2)13-25(33)30(27)28(29)23-16-21-10-6-7-11-22(21)31(23)17-20-8-4-3-5-9-20/h3-11,16,18-19,28H,12-15,17H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.82E+5n/an/an/an/an/an/a



Central University of Punjab

Curated by ChEMBL


Assay Description
Displacement of Fluormone-tagged ES2 from human recombinant ERalpha after 2 hrs by fluorescence polarization assay

Bioorg Med Chem 26: 266-277 (2018)


Article DOI: 10.1016/j.bmc.2017.11.040
BindingDB Entry DOI: 10.7270/Q2K64MNF
More data for this
Ligand-Target Pair