BDBM50237325 CHEMBL4091477

SMILES: CC(C)c1ccc(cc1)N1CCc2cc(O)ccc2C1(C(F)F)c1ccc(\C=C\C(O)=O)cc1

InChI Key: InChIKey=XYMCJJPVJGRECP-LHHJGKSTSA-N

Data: 1 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 1 hit for monomerid = 50237325   

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))	BDBM50237325 (CHEMBL4091477) Show SMILES CC(C)c1ccc(cc1)N1CCc2cc(O)ccc2C1(C(F)F)c1ccc(\C=C\C(O)=O)cc1 Show InChI InChI=1S/C28H27F2NO3/c1-18(2)20-6-10-23(11-7-20)31-16-15-21-17-24(32)12-13-25(21)28(31,27(29)30)22-8-3-19(4-9-22)5-14-26(33)34/h3-14,17-18,27,32H,15-16H2,1-2H3,(H,33,34)/b14-5+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of recombinant Cyclin-dependent kinase 1-cyclin B				J Med Chem 60: 2790-2818 (2017) Article DOI: 10.1021/acs.jmedchem.6b01468 BindingDB Entry DOI: 10.7270/Q2DB845Q
					More data for this Ligand-Target Pair