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BDBM50127739 (E)-3-[5,6-Bis-(biphenyl-4-ylmethoxy)-3-(3,4-difluoro-phenoxy)-benzo[b]thiophen-2-yl]-2-pyridin-4-yl-acrylic acid::CHEMBL44584

SMILES: OC(=O)C(=C\c1sc2cc(OCc3ccc(cc3)-c3ccccc3)c(OCc3ccc(cc3)-c3ccccc3)cc2c1Oc1ccc(F)c(F)c1)\c1ccncc1

InChI Key: InChIKey=QOONAMFSJFYYLA-XOKHWMEBSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50127739   
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))
BDBM50127739
PNG
((E)-3-[5,6-Bis-(biphenyl-4-ylmethoxy)-3-(3,4-diflu...)
Show SMILES OC(=O)C(=C\c1sc2cc(OCc3ccc(cc3)-c3ccccc3)c(OCc3ccc(cc3)-c3ccccc3)cc2c1Oc1ccc(F)c(F)c1)\c1ccncc1
Show InChI InChI=1S/C48H33F2NO5S/c49-41-20-19-38(25-42(41)50)56-47-40-26-43(54-29-31-11-15-35(16-12-31)33-7-3-1-4-8-33)44(55-30-32-13-17-36(18-14-32)34-9-5-2-6-10-34)28-45(40)57-46(47)27-39(48(52)53)37-21-23-51-24-22-37/h1-28H,29-30H2,(H,52,53)/b39-27+
PDB
MMDB

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Similars

PubMed
n/an/a 590n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibitory activity against plasminogen activator inhibitor 1 (PAI-1) was evaluated by inhibition of tissue plasminogen activator/PAI-1 complex forma...


Bioorg Med Chem Lett 13: 1705-8 (2003)


BindingDB Entry DOI: 10.7270/Q2J965SB
More data for this
Ligand-Target Pair