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PubMed code 1433218

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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
Trypsin I


(Bos taurus (bovine))
BDBM50230149
PNG
(CHEMBL1161040)
Show SMILES NC(=N)Nc1ccc(cc1)C1CC(=O)O\C(C1)=C\I
Show InChI InChI=1S/C13H14IN3O2/c14-7-11-5-9(6-12(18)19-11)8-1-3-10(4-2-8)17-13(15)16/h1-4,7,9H,5-6H2,(H4,15,16,17)/b11-7+
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PC cid
PC sid
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Article
PubMed
n/an/an/a 0.0200n/an/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Decylation rate constant against trypsin


J Med Chem 35: 4150-9 (1992)


Article DOI: 10.1021/jm00100a021
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator/surface receptor


(Homo sapiens (Human))
BDBM50003740
PNG
((Lactone IIa)N-[4-(2-Methylene-6-oxo-tetrahydro-py...)
Show SMILES NC(N)=Nc1ccc(cc1)C1CC(=C)OC(=O)C1
Show InChI InChI=1S/C13H15N3O2/c1-8-6-10(7-12(17)18-8)9-2-4-11(5-3-9)16-13(14)15/h2-5,10H,1,6-7H2,(H4,14,15,16)
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KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/a 0.00900n/an/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Decylation rate constant against Urokinase-type plasminogen activator


J Med Chem 35: 4150-9 (1992)


Article DOI: 10.1021/jm00100a021
More data for this
Ligand-Target Pair
Trypsin I


(Bos taurus (bovine))
BDBM50003740
PNG
((Lactone IIa)N-[4-(2-Methylene-6-oxo-tetrahydro-py...)
Show SMILES NC(N)=Nc1ccc(cc1)C1CC(=C)OC(=O)C1
Show InChI InChI=1S/C13H15N3O2/c1-8-6-10(7-12(17)18-8)9-2-4-11(5-3-9)16-13(14)15/h2-5,10H,1,6-7H2,(H4,14,15,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/a 0.00200n/an/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Decylation rate constant against trypsin


J Med Chem 35: 4150-9 (1992)


Article DOI: 10.1021/jm00100a021
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%