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SMILES: COc1cccc(CNc2ccc(N3CCN(CC3)c3cccc(c3)C(F)(F)F)c(c2)C(F)(F)F)c1Oc1ccc(cn1)C(O)=O

InChI Key: InChIKey=JYARIAKSSCLDEP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50139546   
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))		BDBM50139546
PNG
(6-[2-Methoxy-6-({3-trifluoromethyl-4-[4-(3-trifluo...)
Show SMILES COc1cccc(CNc2ccc(N3CCN(CC3)c3cccc(c3)C(F)(F)F)c(c2)C(F)(F)F)c1Oc1ccc(cn1)C(O)=O
Show InChI InChI=1S/C32H28F6N4O4/c1-45-27-7-2-4-20(29(27)46-28-11-8-21(19-40-28)30(43)44)18-39-23-9-10-26(25(17-23)32(36,37)38)42-14-12-41(13-15-42)24-6-3-5-22(16-24)31(33,34)35/h2-11,16-17,19,39H,12-15,18H2,1H3,(H,43,44)
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MMDB

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n/an/a 900n/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Inhibitory concentration against plasminogen activator inhibitor-1 (PAI-1)

Bioorg Med Chem Lett 14: 761-5 (2004)


BindingDB Entry DOI: 10.7270/Q26T0M23
More data for this
Ligand-Target Pair