BDBM50180049 3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propionic acid::CHEMBL200061

SMILES: CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1

InChI Key: InChIKey=IXOKIWZMTKUQKC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50180049   

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
Transcription factor AP-1 (Homo sapiens (Human))	BDBM50180049 (3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propio...) Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1 Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-9-5-18(6-10-21)24(27)20-7-11-22(29-15-17(3)4)19(13-20)8-12-23(25)26/h5-7,9-11,13,16-17H,8,12,14-15H2,1-4H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of AP-1 (unknown origin) expressed in TPA-stimulated mouse NIH3T3 cells by luciferase reporter gene assay				J Med Chem 57: 6930-48 (2014) Article DOI: 10.1021/jm5004733 BindingDB Entry DOI: 10.7270/Q2222WDT
					More data for this Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos (Homo sapiens (Human))	BDBM50180049 (3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propio...) Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1 Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-9-5-18(6-10-21)24(27)20-7-11-22(29-15-17(3)4)19(13-20)8-12-23(25)26/h5-7,9-11,13,16-17H,8,12,14-15H2,1-4H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Toyama Chemical Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of the expression of AP1-luciferase by TPA-stimulated NIH3T3 cells				J Med Chem 49: 80-91 (2006) Article DOI: 10.1021/jm050550d BindingDB Entry DOI: 10.7270/Q2VX0G2C
					More data for this Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos (Homo sapiens (Human))	BDBM50180049 (3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propio...) Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1 Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-9-5-18(6-10-21)24(27)20-7-11-22(29-15-17(3)4)19(13-20)8-12-23(25)26/h5-7,9-11,13,16-17H,8,12,14-15H2,1-4H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Toyama Chemical Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory activity on AP1 using ELISA based AP1 DNA binding				J Med Chem 49: 80-91 (2006) Article DOI: 10.1021/jm050550d BindingDB Entry DOI: 10.7270/Q2VX0G2C
					More data for this Ligand-Target Pair