BDBM50517931 CHEMBL4444171

SMILES: Oc1ccc(cc1C=O)C1CCC(=C)CC1

InChI Key: InChIKey=DEUXKRKYAFBTJQ-UHFFFAOYSA-N

Data: 1 EC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50517931   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Estrogen receptor (Homo sapiens (Human))	BDBM50517931 (CHEMBL4444171) Show SMILES Oc1ccc(cc1C=O)C1CCC(=C)CC1 Show InChI InChI=1S/C14H16O2/c1-10-2-4-11(5-3-10)12-6-7-14(16)13(8-12)9-15/h6-9,11,16H,1-5H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a
Concordia University Wisconsin Curated by ChEMBL					Assay Description Binding affinity to human GST-tagged estrogen receptor beta ligand binding domain after 1 hr by TR-FRET assay				J Med Chem 61: 4720-4738 (2018) Article DOI: 10.1021/acs.jmedchem.7b01601
					More data for this Ligand-Target Pair