BDBM50133115 5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-biphenyl-2-yl]-3-methyl-penta-2,4-dienoic acid::CHEMBL445634

SMILES: CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O

InChI Key: InChIKey=KWICUVGFGSNCGA-POQLEOJZSA-N

Data: 8 KI  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 9 hits for monomerid = 50133115   

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
NR2B Channel Blocker (RAT)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	15	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 for Retinoic acid receptor RXR-alpha was determined by competing with 3[H]-9-cis-RA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoid X receptor beta (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	24	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 for Retinoic acid receptor RXR-beta was determined by competing with 3[H]-9-cis-RA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoid X receptor gamma (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	49	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 for Retinoic acid receptor RXR-gamma was determined by competing with 3[H]-9-cis-RA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoic acid receptor alpha (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7.50E+3	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 for Retinoic acid receptor alpha was determined by competing with 3[H]-ATRA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoid receptor (Homo sapiens (Human))	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt 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 for Retinoic acid receptor beta was determined by competing with 3[H]-ATRA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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 for peroxisome Peroxisome proliferator activated receptor alpha was determined				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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 for Peroxisome proliferator activated receptor gamma was determined				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoic acid receptor gamma (Rattus norvegicus)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD 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 for Retinoic acid receptor gamma was determined by competing with 3[H]-ATRA				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair
Retinoid X receptor alpha (RAT)	BDBM50133115 (5-[2'-(3-Fluoro-propoxy)-3',5'-diisopropyl-bipheny...) Show SMILES CC(C)c1cc(C(C)C)c(OCCCF)c(c1)-c1ccccc1\C=C\C(\C)=C\C(O)=O Show InChI InChI=1S/C27H33FO3/c1-18(2)22-16-24(19(3)4)27(31-14-8-13-28)25(17-22)23-10-7-6-9-21(23)12-11-20(5)15-26(29)30/h6-7,9-12,15-19H,8,13-14H2,1-5H3,(H,29,30)/b12-11+,20-15+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description In vitro inhibition of 5-(125I)A-85380 binding to nicotinic acetylcholine receptor (nAChR) of rat brain				J Med Chem 46: 4087-103 (2003) Article DOI: 10.1021/jm020401k BindingDB Entry DOI: 10.7270/Q2VM4BNR
					More data for this Ligand-Target Pair