BindingDB logo
myBDB logout

null

SMILES: [H][C@@]12CC[C@H](O)[C@@]1(C)C[C@H](CCCCCCCCCCOS(=O)(=O)c1ccc(C)cc1)[C@]1([H])c3ccc(O)cc3CC[C@@]21[H]

InChI Key: InChIKey=UDAQLYMFTARBIE-AHBRDIEGSA-N

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 1 hit for monomerid = 50471259   
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))		BDBM50471259
PNG
(CHEMBL1627458)
Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)C[C@H](CCCCCCCCCCOS(=O)(=O)c1ccc(C)cc1)[C@]1([H])c3ccc(O)cc3CC[C@@]21[H]
Show InChI InChI=1S/C35H50O5S/c1-25-12-16-29(17-13-25)41(38,39)40-22-10-8-6-4-3-5-7-9-11-27-24-35(2)32(20-21-33(35)37)31-18-14-26-23-28(36)15-19-30(26)34(27)31/h12-13,15-17,19,23,27,31-34,36-37H,3-11,14,18,20-22,24H2,1-2H3/t27-,31-,32-,33-,34+,35-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4n/an/an/an/an/an/a



INSERM Unit� 439

Curated by ChEMBL


Assay Description
Compound concentration required to induce transcriptional activation in MVLN cells equal to 50% of 0.1 nM estradiol response

J Med Chem 40: 2217-27 (1997)


Article DOI: 10.1021/jm970019l
BindingDB Entry DOI: 10.7270/Q20G3NVN
More data for this
Ligand-Target Pair