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BDBM50454576 CHEMBL4202481

SMILES: OC(=O)c1cc(Cl)ccc1NC(=O)c1cccc(c1)C12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=UXSVQZKMKNVUKE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50454576   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Plasminogen activator inhibitor-1


(Homo sapiens (Human))		BDBM50454576
PNG
(CHEMBL4202481)
Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1cccc(c1)C12CC3CC(CC(C3)C1)C2 |TLB:26:21:28:25.27.24,26:25:28:22.21.20,THB:24:23:20:26.25.27,24:25:28.23.22:20|
Show InChI InChI=1S/C24H24ClNO3/c25-19-4-5-21(20(10-19)23(28)29)26-22(27)17-2-1-3-18(9-17)24-11-14-6-15(12-24)8-16(7-14)13-24/h1-5,9-10,14-16H,6-8,11-13H2,(H,26,27)(H,28,29)
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n/an/a 1.86E+3n/an/an/an/an/an/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