BDBM50148107 2-Ethyl-7-{3-[4-(4-methanesulfonyl-phenoxy)-2-propyl-phenoxy]-propoxy}-chroman-2-carboxylic acid::CHEMBL113324

SMILES: CCCc1cc(Oc2ccc(cc2)S(C)(=O)=O)ccc1OCCCOc1ccc2CCC(CC)(Oc2c1)C(O)=O

InChI Key: InChIKey=DMHJQMGELZSRPT-UHFFFAOYSA-N

Data: 2 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 3 hits for monomerid = 50148107   

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
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50148107 (2-Ethyl-7-{3-[4-(4-methanesulfonyl-phenoxy)-2-prop...) Show SMILES CCCc1cc(Oc2ccc(cc2)S(C)(=O)=O)ccc1OCCCOc1ccc2CCC(CC)(Oc2c1)C(O)=O Show InChI InChI=1S/C31H36O8S/c1-4-7-23-20-26(38-24-10-13-27(14-11-24)40(3,34)35)12-15-28(23)37-19-6-18-36-25-9-8-22-16-17-31(5-2,30(32)33)39-29(22)21-25/h8-15,20-21H,4-7,16-19H2,1-3H3,(H,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity for human PPAR gamma receptor using scintillation proximity assay (SPA)				J Med Chem 47: 3255-63 (2004) Article DOI: 10.1021/jm030621d BindingDB Entry DOI: 10.7270/Q2JW8DB1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50148107 (2-Ethyl-7-{3-[4-(4-methanesulfonyl-phenoxy)-2-prop...) Show SMILES CCCc1cc(Oc2ccc(cc2)S(C)(=O)=O)ccc1OCCCOc1ccc2CCC(CC)(Oc2c1)C(O)=O Show InChI InChI=1S/C31H36O8S/c1-4-7-23-20-26(38-24-10-13-27(14-11-24)40(3,34)35)12-15-28(23)37-19-6-18-36-25-9-8-22-16-17-31(5-2,30(32)33)39-29(22)21-25/h8-15,20-21H,4-7,16-19H2,1-3H3,(H,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro potency of PPAR gene activation against human PPAR gamma receptor using chimeric Gal4-hPPAR transactivation assay (TA)				J Med Chem 47: 3255-63 (2004) Article DOI: 10.1021/jm030621d BindingDB Entry DOI: 10.7270/Q2JW8DB1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha) (Homo sapiens (Human))	BDBM50148107 (2-Ethyl-7-{3-[4-(4-methanesulfonyl-phenoxy)-2-prop...) Show SMILES CCCc1cc(Oc2ccc(cc2)S(C)(=O)=O)ccc1OCCCOc1ccc2CCC(CC)(Oc2c1)C(O)=O Show InChI InChI=1S/C31H36O8S/c1-4-7-23-20-26(38-24-10-13-27(14-11-24)40(3,34)35)12-15-28(23)37-19-6-18-36-25-9-8-22-16-17-31(5-2,30(32)33)39-29(22)21-25/h8-15,20-21H,4-7,16-19H2,1-3H3,(H,32,33)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity for human peroxisome proliferator activated receptor alpha using scintillation proximity assay (SPA)				J Med Chem 47: 3255-63 (2004) Article DOI: 10.1021/jm030621d BindingDB Entry DOI: 10.7270/Q2JW8DB1
					More data for this Ligand-Target Pair