BDBM50111296 8-(4-{[4-Hydroxy-1-(4-isopropyl-phenyl)-2-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl]-amino}-phenoxy)-octanoic acid::CHEMBL416333

SMILES: CC(C)c1ccc(cc1)N1CC(=O)C(C(=O)Nc2ccc(OCCCCCCCC(O)=O)cc2)C1=O

InChI Key: InChIKey=FSVPQLDRWGYWRK-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50111296   

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
Plasminogen activator inhibitor-1 (Homo sapiens (Human))	BDBM50111296 (8-(4-{[4-Hydroxy-1-(4-isopropyl-phenyl)-2-oxo-2,5-...) Show SMILES CC(C)c1ccc(cc1)N1CC(=O)C(C(=O)Nc2ccc(OCCCCCCCC(O)=O)cc2)C1=O Show InChI InChI=1S/C28H34N2O6/c1-19(2)20-9-13-22(14-10-20)30-18-24(31)26(28(30)35)27(34)29-21-11-15-23(16-12-21)36-17-7-5-3-4-6-8-25(32)33/h9-16,19,26H,3-8,17-18H2,1-2H3,(H,29,34)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Xenova Limited Curated by ChEMBL					Assay Description Inhibitory activity against human plasminogen activator inhibitor-1(PAI-1) evaluated by chromogenic assay.				Bioorg Med Chem Lett 12: 1063-6 (2002) BindingDB Entry DOI: 10.7270/Q2W958HQ
					More data for this Ligand-Target Pair