BDBM50146335 (E)-3-{3-[2-(3-Fluoro-propoxy)-3,5-diisopropyl-phenyl]-benzo[b]thiophen-5-yl}-but-2-enoic acid::CHEMBL264746

SMILES: CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1csc2ccc(cc12)C(\C)=C\C(O)=O

InChI Key: InChIKey=XRDUYAHKXLABIN-WOJGMQOQSA-N

Data: 2 KI  1 EC50

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 3 hits for monomerid = 50146335   

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
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50146335 ((E)-3-{3-[2-(3-Fluoro-propoxy)-3,5-diisopropyl-phe...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1csc2ccc(cc12)C(\C)=C\C(O)=O Show InChI InChI=1S/C27H31FO3S/c1-16(2)20-13-21(17(3)4)27(31-10-6-9-28)23(14-20)24-15-32-25-8-7-19(12-22(24)25)18(5)11-26(29)30/h7-8,11-17H,6,9-10H2,1-5H3,(H,29,30)/b18-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	395	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [3H]-9-cis-RA from Retinoid X receptor alpha in CV-1 cells				Bioorg Med Chem Lett 14: 2759-63 (2004) Article DOI: 10.1016/j.bmcl.2004.03.073 BindingDB Entry DOI: 10.7270/Q2513XNB
					More data for this Ligand-Target Pair
Retinoid receptor (Homo sapiens (Human))	BDBM50146335 ((E)-3-{3-[2-(3-Fluoro-propoxy)-3,5-diisopropyl-phe...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1csc2ccc(cc12)C(\C)=C\C(O)=O Show InChI InChI=1S/C27H31FO3S/c1-16(2)20-13-21(17(3)4)27(31-10-6-9-28)23(14-20)24-15-32-25-8-7-19(12-22(24)25)18(5)11-26(29)30/h7-8,11-17H,6,9-10H2,1-5H3,(H,29,30)/b18-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [3H]-ATRA from Retinoic acid receptor gamma in CV-1 cells				Bioorg Med Chem Lett 14: 2759-63 (2004) Article DOI: 10.1016/j.bmcl.2004.03.073 BindingDB Entry DOI: 10.7270/Q2513XNB
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50146335 ((E)-3-{3-[2-(3-Fluoro-propoxy)-3,5-diisopropyl-phe...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1csc2ccc(cc12)C(\C)=C\C(O)=O Show InChI InChI=1S/C27H31FO3S/c1-16(2)20-13-21(17(3)4)27(31-10-6-9-28)23(14-20)24-15-32-25-8-7-19(12-22(24)25)18(5)11-26(29)30/h7-8,11-17H,6,9-10H2,1-5H3,(H,29,30)/b18-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	4.15E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Effective concentration for antagonistic activity against RXR-alpha expressed in CV-1 cells				Bioorg Med Chem Lett 14: 2759-63 (2004) Article DOI: 10.1016/j.bmcl.2004.03.073 BindingDB Entry DOI: 10.7270/Q2513XNB
					More data for this Ligand-Target Pair