BDBM50166300 (S)-2-{2-Chloro-5-[1-(6-chloro-benzo[d]isoxazol-3-yl)-2-methyl-5-trifluoromethoxy-1H-indol-3-ylmethyl]-phenoxy}-propionic acid::CHEMBL371341

SMILES: C[C@H](Oc1cc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)ccc1Cl)C(O)=O

InChI Key: InChIKey=PESUMSRASMUYKX-ZDUSSCGKSA-N

Data: 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 2 hits for monomerid = 50166300   

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))	BDBM50166300 ((S)-2-{2-Chloro-5-[1-(6-chloro-benzo[d]isoxazol-3-...) Show SMILES C[C@H](Oc1cc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)ccc1Cl)C(O)=O |wU:1.0,(11.52,1.27,;11.04,-.19,;9.55,-.52,;8.51,.64,;7.01,.32,;5.98,1.43,;4.48,1.11,;4,-.36,;4.91,-1.61,;6.44,-1.61,;4,-2.84,;4.41,-4.33,;3.45,-5.51,;4.3,-6.81,;5.77,-6.42,;7.06,-7.25,;8.43,-6.56,;9.72,-7.37,;8.5,-5,;7.22,-4.17,;5.86,-4.89,;2.54,-2.38,;1.22,-3.14,;-.13,-2.38,;-.13,-.84,;-1.48,-.05,;-2.8,-.84,;-4.15,-1.63,;-3.59,.5,;-2.01,-2.17,;1.22,-.05,;2.54,-.82,;6.46,2.92,;7.95,3.24,;9,2.11,;10.5,2.41,;12.09,-1.33,;11.6,-2.79,;13.6,-1.01,)| Show InChI InChI=1S/C26H17Cl2F3N2O6/c1-12-23(37-15-4-7-19(28)22(11-15)36-13(2)25(34)35)18-10-16(38-26(29,30)31)5-8-20(18)33(12)24-17-6-3-14(27)9-21(17)39-32-24/h3-11,13H,1-2H3,(H,34,35)/t13-/m0/s1	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	3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Maximal intrinsic response against peroxisome proliferator activated receptor gamma transactivation				Bioorg Med Chem Lett 15: 2437-40 (2005) Article DOI: 10.1016/j.bmcl.2005.03.092 BindingDB Entry DOI: 10.7270/Q2CF9PM8
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50166300 ((S)-2-{2-Chloro-5-[1-(6-chloro-benzo[d]isoxazol-3-...) Show SMILES C[C@H](Oc1cc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)ccc1Cl)C(O)=O |wU:1.0,(11.52,1.27,;11.04,-.19,;9.55,-.52,;8.51,.64,;7.01,.32,;5.98,1.43,;4.48,1.11,;4,-.36,;4.91,-1.61,;6.44,-1.61,;4,-2.84,;4.41,-4.33,;3.45,-5.51,;4.3,-6.81,;5.77,-6.42,;7.06,-7.25,;8.43,-6.56,;9.72,-7.37,;8.5,-5,;7.22,-4.17,;5.86,-4.89,;2.54,-2.38,;1.22,-3.14,;-.13,-2.38,;-.13,-.84,;-1.48,-.05,;-2.8,-.84,;-4.15,-1.63,;-3.59,.5,;-2.01,-2.17,;1.22,-.05,;2.54,-.82,;6.46,2.92,;7.95,3.24,;9,2.11,;10.5,2.41,;12.09,-1.33,;11.6,-2.79,;13.6,-1.01,)| Show InChI InChI=1S/C26H17Cl2F3N2O6/c1-12-23(37-15-4-7-19(28)22(11-15)36-13(2)25(34)35)18-10-16(38-26(29,30)31)5-8-20(18)33(12)24-17-6-3-14(27)9-21(17)39-32-24/h3-11,13H,1-2H3,(H,34,35)/t13-/m0/s1	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	1	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human peroxisome proliferator activated receptor gamma binding				Bioorg Med Chem Lett 15: 2437-40 (2005) Article DOI: 10.1016/j.bmcl.2005.03.092 BindingDB Entry DOI: 10.7270/Q2CF9PM8
					More data for this Ligand-Target Pair