BDBM50276813 CHEMBL4170236

SMILES: COc1ccc(Cn2ncc3cc(\C=C4/SC(=O)N(CCN5CCCC5)C4=O)ccc23)c(c1)C(F)(F)F

InChI Key: InChIKey=ZEYSCDZTWZRETO-QRVIBDJDSA-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 = 50276813   

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-related receptor alpha (Homo sapiens (Human))	BDBM50276813 (CHEMBL4170236) Show SMILES COc1ccc(Cn2ncc3cc(\C=C4/SC(=O)N(CCN5CCCC5)C4=O)ccc23)c(c1)C(F)(F)F Show InChI InChI=1S/C26H25F3N4O3S/c1-36-20-6-5-18(21(14-20)26(27,28)29)16-33-22-7-4-17(12-19(22)15-30-33)13-23-24(34)32(25(35)37-23)11-10-31-8-2-3-9-31/h4-7,12-15H,2-3,8-11,16H2,1H3/b23-13-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Research and Development LLC Curated by ChEMBL					Assay Description Antagonist activity at His6-tagged ERRalpha LBD (unknown origin) assessed as inhibition of GST-tagged SRC-2 co-activator peptide recruitment after 18...				Eur J Med Chem 138: 830-853 (2017) Article DOI: 10.1016/j.ejmech.2017.07.015 BindingDB Entry DOI: 10.7270/Q2W098F7
					More data for this Ligand-Target Pair