BDBM50166293 (S)-2-{3-[1-(6-Chloro-benzo[d]isoxazol-3-yl)-2-methyl-5-trifluoromethoxy-1H-indol-3-ylmethyl]-phenoxy}-propionic acid::CHEMBL192646

SMILES: C[C@H](Oc1cccc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)c1)C(O)=O

InChI Key: InChIKey=VGORCQXXKHIAFG-AWEZNQCLSA-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 = 50166293   

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))	BDBM50166293 ((S)-2-{3-[1-(6-Chloro-benzo[d]isoxazol-3-yl)-2-met...) Show SMILES C[C@H](Oc1cccc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)c1)C(O)=O |wU:1.0,(13.85,3.3,;13.37,1.84,;11.87,1.53,;10.83,2.67,;11.32,4.14,;10.28,5.27,;8.78,4.95,;8.3,3.48,;6.81,3.15,;6.33,1.67,;7.23,.42,;8.77,.42,;6.33,-.81,;6.74,-2.3,;5.77,-3.48,;6.62,-4.79,;8.09,-4.38,;9.39,-5.21,;10.76,-4.51,;12.04,-5.34,;10.83,-2.97,;9.55,-2.14,;8.19,-2.84,;4.86,-.33,;3.54,-1.12,;2.19,-.33,;2.19,1.2,;.84,1.97,;-.48,1.2,;-1.27,2.53,;.31,-.14,;-1.83,.41,;3.54,1.97,;4.86,1.21,;9.34,2.35,;14.41,.7,;13.92,-.77,;15.92,1.02,)| Show InChI InChI=1S/C26H18ClF3N2O6/c1-13-23(36-17-5-3-4-16(11-17)35-14(2)25(33)34)20-12-18(37-26(28,29)30)7-9-21(20)32(13)24-19-8-6-15(27)10-22(19)38-31-24/h3-12,14H,1-2H3,(H,33,34)/t14-/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	195	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))	BDBM50166293 ((S)-2-{3-[1-(6-Chloro-benzo[d]isoxazol-3-yl)-2-met...) Show SMILES C[C@H](Oc1cccc(Oc2c(C)n(-c3noc4cc(Cl)ccc34)c3ccc(OC(F)(F)F)cc23)c1)C(O)=O |wU:1.0,(13.85,3.3,;13.37,1.84,;11.87,1.53,;10.83,2.67,;11.32,4.14,;10.28,5.27,;8.78,4.95,;8.3,3.48,;6.81,3.15,;6.33,1.67,;7.23,.42,;8.77,.42,;6.33,-.81,;6.74,-2.3,;5.77,-3.48,;6.62,-4.79,;8.09,-4.38,;9.39,-5.21,;10.76,-4.51,;12.04,-5.34,;10.83,-2.97,;9.55,-2.14,;8.19,-2.84,;4.86,-.33,;3.54,-1.12,;2.19,-.33,;2.19,1.2,;.84,1.97,;-.48,1.2,;-1.27,2.53,;.31,-.14,;-1.83,.41,;3.54,1.97,;4.86,1.21,;9.34,2.35,;14.41,.7,;13.92,-.77,;15.92,1.02,)| Show InChI InChI=1S/C26H18ClF3N2O6/c1-13-23(36-17-5-3-4-16(11-17)35-14(2)25(33)34)20-12-18(37-26(28,29)30)7-9-21(20)32(13)24-19-8-6-15(27)10-22(19)38-31-24/h3-12,14H,1-2H3,(H,33,34)/t14-/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	33	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