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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Plasminogen' and Ligand = 'BDBM50114443'   
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))
BDBM50114443
PNG
(5-Methyl-2-(3-sulfamoyl-naphthalen-2-yl)-2H-pyrazo...)
Show SMILES Cc1cc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)n(n1)-c1cc2ccccc2cc1S(N)(=O)=O
Show InChI InChI=1S/C27H23N5O5S2/c1-17-14-24(32(31-17)23-15-19-6-2-3-7-20(19)16-26(23)39(29,36)37)27(33)30-21-12-10-18(11-13-21)22-8-4-5-9-25(22)38(28,34)35/h2-16H,1H3,(H,30,33)(H2,28,34,35)(H2,29,36,37)
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MMDB

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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue plasminogen activator


Bioorg Med Chem Lett 12: 1651-5 (2002)


BindingDB Entry DOI: 10.7270/Q2VT1RFZ
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50114443
PNG
(5-Methyl-2-(3-sulfamoyl-naphthalen-2-yl)-2H-pyrazo...)
Show SMILES Cc1cc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)n(n1)-c1cc2ccccc2cc1S(N)(=O)=O
Show InChI InChI=1S/C27H23N5O5S2/c1-17-14-24(32(31-17)23-15-19-6-2-3-7-20(19)16-26(23)39(29,36)37)27(33)30-21-12-10-18(11-13-21)22-8-4-5-9-25(22)38(28,34)35/h2-16H,1H3,(H,30,33)(H2,28,34,35)(H2,29,36,37)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin


Bioorg Med Chem Lett 12: 1651-5 (2002)


BindingDB Entry DOI: 10.7270/Q2VT1RFZ
More data for this
Ligand-Target Pair