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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Plasminogen' and Ligand = 'BDBM50093134'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Plasminogen


(Homo sapiens (Human))
BDBM50093134
PNG
(CHEMBL79655 | Derivative of piperazine-1-carboxyli...)
Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#7]-2-[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#8]-[#6@@H]-2-[#6]-[#6]-[#6]-[#6@@H](-[#6]-[#6]-[#6]-2)-[#8]-[#6](=O)-[#7]-2-[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#7]-[#6]-c2ccccc2)cc1
Show InChI InChI=1S/C35H49N9O6/c36-31(37)40-28-14-12-27(13-15-28)25-39-33(46)42-18-22-44(23-19-42)35(48)50-30-10-4-8-29(9-5-11-30)49-34(47)43-20-16-41(17-21-43)32(45)38-24-26-6-2-1-3-7-26/h1-3,6-7,12-15,29-30H,4-5,8-11,16-25H2,(H,38,45)(H,39,46)(H4,36,37,40)/t29-,30+
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PC cid
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Similars

PubMed
>1.00E+6n/an/an/an/an/an/an/an/a



Axys Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its inhibitory potency against plasmin


Bioorg Med Chem Lett 10: 2361-6 (2001)


BindingDB Entry DOI: 10.7270/Q2HX1BWR
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50093134
PNG
(CHEMBL79655 | Derivative of piperazine-1-carboxyli...)
Show SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#7]-[#6](=O)-[#7]-2-[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#8]-[#6@@H]-2-[#6]-[#6]-[#6]-[#6@@H](-[#6]-[#6]-[#6]-2)-[#8]-[#6](=O)-[#7]-2-[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#7]-[#6]-c2ccccc2)cc1
Show InChI InChI=1S/C35H49N9O6/c36-31(37)40-28-14-12-27(13-15-28)25-39-33(46)42-18-22-44(23-19-42)35(48)50-30-10-4-8-29(9-5-11-30)49-34(47)43-20-16-41(17-21-43)32(45)38-24-26-6-2-1-3-7-26/h1-3,6-7,12-15,29-30H,4-5,8-11,16-25H2,(H,38,45)(H,39,46)(H4,36,37,40)/t29-,30+
PDB
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PubMed
>1.00E+6n/an/an/an/an/an/an/an/a



Axys Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory potency against plasmin


Bioorg Med Chem Lett 10: 2357-60 (2001)


BindingDB Entry DOI: 10.7270/Q2NP23NX
More data for this
Ligand-Target Pair