BDBM50129721 7-[2-(2,2-Difluoro-ethoxy)-3,5-bis-(1,1-dimethyl-propyl)-phenyl]-3-methyl-octa-2,4,6-trienoic acid::CHEMBL313647

SMILES: CCC(C)(C)c1cc(\C(C)=C/C=C/C(/C)=C/C(O)=O)c(OCC(F)F)c(c1)C(C)(C)CC

InChI Key: InChIKey=HHIXIADJLOVLQC-BVSJNERWSA-N

Data: 2 KI  1 IC50  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 4 hits for monomerid = 50129721   

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))	BDBM50129721 (7-[2-(2,2-Difluoro-ethoxy)-3,5-bis-(1,1-dimethyl-p...) Show SMILES CCC(C)(C)c1cc(\C(C)=C/C=C/C(/C)=C/C(O)=O)c(OCC(F)F)c(c1)C(C)(C)CC Show InChI InChI=1S/C27H38F2O3/c1-9-26(5,6)20-15-21(19(4)13-11-12-18(3)14-24(30)31)25(32-17-23(28)29)22(16-20)27(7,8)10-2/h11-16,23H,9-10,17H2,1-8H3,(H,30,31)/b12-11+,18-14+,19-13-	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	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc Curated by ChEMBL					Assay Description Binding affinity against Retinoic acid receptor RXR-alpha was determined in vitro by using [3H]-9-cis-RA as radioligand				J Med Chem 46: 2683-96 (2003) Article DOI: 10.1021/jm020340q BindingDB Entry DOI: 10.7270/Q27H1HZ3
					More data for this Ligand-Target Pair
Retinoid receptor (Homo sapiens (Human))	BDBM50129721 (7-[2-(2,2-Difluoro-ethoxy)-3,5-bis-(1,1-dimethyl-p...) Show SMILES CCC(C)(C)c1cc(\C(C)=C/C=C/C(/C)=C/C(O)=O)c(OCC(F)F)c(c1)C(C)(C)CC Show InChI InChI=1S/C27H38F2O3/c1-9-26(5,6)20-15-21(19(4)13-11-12-18(3)14-24(30)31)25(32-17-23(28)29)22(16-20)27(7,8)10-2/h11-16,23H,9-10,17H2,1-8H3,(H,30,31)/b12-11+,18-14+,19-13-	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
Ligand Pharmaceuticals, Inc Curated by ChEMBL					Assay Description Binding affinity against Retinoic acid receptor gamma was determined in vitro by using [3H]-ATRA as radioligand				J Med Chem 46: 2683-96 (2003) Article DOI: 10.1021/jm020340q BindingDB Entry DOI: 10.7270/Q27H1HZ3
					More data for this Ligand-Target Pair
Peroxisome Proliferator-Activated Receptor gamma/Retinoid X receptor alpha (Homo sapiens (Human))	BDBM50129721 (7-[2-(2,2-Difluoro-ethoxy)-3,5-bis-(1,1-dimethyl-p...) Show SMILES CCC(C)(C)c1cc(\C(C)=C/C=C/C(/C)=C/C(O)=O)c(OCC(F)F)c(c1)C(C)(C)CC Show InChI InChI=1S/C27H38F2O3/c1-9-26(5,6)20-15-21(19(4)13-11-12-18(3)14-24(30)31)25(32-17-23(28)29)22(16-20)27(7,8)10-2/h11-16,23H,9-10,17H2,1-8H3,(H,30,31)/b12-11+,18-14+,19-13-	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc Curated by ChEMBL					Assay Description Transcriptional activity against RXR:PPAR-gamma synergy was determined in vitro				J Med Chem 46: 2683-96 (2003) Article DOI: 10.1021/jm020340q BindingDB Entry DOI: 10.7270/Q27H1HZ3
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50129721 (7-[2-(2,2-Difluoro-ethoxy)-3,5-bis-(1,1-dimethyl-p...) Show SMILES CCC(C)(C)c1cc(\C(C)=C/C=C/C(/C)=C/C(O)=O)c(OCC(F)F)c(c1)C(C)(C)CC Show InChI InChI=1S/C27H38F2O3/c1-9-26(5,6)20-15-21(19(4)13-11-12-18(3)14-24(30)31)25(32-17-23(28)29)22(16-20)27(7,8)10-2/h11-16,23H,9-10,17H2,1-8H3,(H,30,31)/b12-11+,18-14+,19-13-	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	16	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc Curated by ChEMBL					Assay Description Inhibitory activity against Retinoic acid receptor RXR-alpha antagonist was determined in vitro				J Med Chem 46: 2683-96 (2003) Article DOI: 10.1021/jm020340q BindingDB Entry DOI: 10.7270/Q27H1HZ3
					More data for this Ligand-Target Pair