BDBM50454586 CHEMBL4206843

SMILES: [Na;v0+].[#8-]-[#6](=O)-c1cc(Cl)ccc1-[#7]-[#6](=O)-c1cccc(c1)-c1cccc2cccnc12

InChI Key: InChIKey=XUHZPZFOUUUAIT-UHFFFAOYSA-M

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 = 50454586   

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))	BDBM50454586 (CHEMBL4206843) Show SMILES [Na;v0+].[#8-]-[#6](=O)-c1cc(Cl)ccc1-[#7]-[#6](=O)-c1cccc(c1)-c1cccc2cccnc12 Show InChI InChI=1S/C23H15ClN2O3/c24-17-9-10-20(19(13-17)23(28)29)26-22(27)16-6-1-5-15(12-16)18-8-2-4-14-7-3-11-25-21(14)18/h1-13H,(H,26,27)(H,28,29)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hamari Chemicals, Ltd. Curated by ChEMBL					Assay Description Inhibition of human PAI-1 assessed as remaining enzyme activity by measuring p-nitroaniline release pre-incubated for 15 mins before 2 nM Spectrozyme...				Bioorg Med Chem Lett 28: 809-813 (2018) Article DOI: 10.1016/j.bmcl.2017.11.016 BindingDB Entry DOI: 10.7270/Q2TH8Q90
					More data for this Ligand-Target Pair