BindingDB logo
myBDB logout

PubMed code 11496832

Compile data set for download or QSAR
Found 7 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
Neutrophil elastase


(Homo sapiens (Human))		BDBM85462
PNG
(Pyrazolooxadiazinone, 2c)
Show SMILES Cc1nn(c2NC(=O)ONc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C11H9ClN4O2/c1-6-9-10(13-11(17)18-15-9)16(14-6)8-4-2-7(12)3-5-8/h2-5,15H,1H3,(H,13,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
 8.70E+4 -23.2n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85460
PNG
(Pyrazolooxadiazinone, 2a)
Show SMILES Cc1nn(c2NC(=O)ONc12)-c1ccccc1
Show InChI InChI=1S/C11H10N4O2/c1-7-9-10(12-11(16)17-14-9)15(13-7)8-5-3-2-4-6-8/h2-6,14H,1H3,(H,12,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
 9.40E+4 -23.0n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85466
PNG
(Pyrazolooxadiazinone, 2l)
Show SMILES CCCCc1nn(C)c2NC(=O)ONc12
Show InChI InChI=1S/C9H14N4O2/c1-3-4-5-6-7-8(13(2)11-6)10-9(14)15-12-7/h12H,3-5H2,1-2H3,(H,10,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
 1.13E+5 -22.5n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85465
PNG
(Pyrazolooxadiazinone, 2j)
Show SMILES CCc1nn(C)c2NC(=O)ONc12
Show InChI InChI=1S/C7H10N4O2/c1-3-4-5-6(11(2)9-4)8-7(12)13-10-5/h10H,3H2,1-2H3,(H,8,12)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
 1.99E+5 -21.1n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85461
PNG
(Pyrazolooxadiazinone, 2b)
Show SMILES Cc1nn(C)c2NC(=O)ONc12
Show InChI InChI=1S/C6H8N4O2/c1-3-4-5(10(2)8-3)7-6(11)12-9-4/h9H,1-2H3,(H,7,11)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
 2.07E+5 -21.0n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85464
PNG
(Pyrazolooxadiazinone, 2h)
Show SMILES Cc1nn(c2NC(=O)ONc12)-c1cccc(c1)N(=O)=O
Show InChI InChI=1S/C11H9N5O4/c1-6-9-10(12-11(17)20-14-9)15(13-6)7-3-2-4-8(5-7)16(18)19/h2-5,14H,1H3,(H,12,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
>8.40E+6>-11.8n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
Neutrophil elastase


(Homo sapiens (Human))		BDBM85463
PNG
(Pyrazolooxadiazinone, 2g)
Show SMILES Cc1nn(c2NC(=O)ONc12)-c1ccccc1N(=O)=O
Show InChI InChI=1S/C11H9N5O4/c1-6-9-10(12-11(17)20-14-9)15(13-6)7-4-2-3-5-8(7)16(18)19/h2-5,14H,1H3,(H,12,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
>8.40E+6>-11.8n/an/an/an/an/an/a25



Università di Ferrara



Assay Description
The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.

J Enzym Inhib 16: 15-34 (2001)


Article DOI: 10.1080/14756360109162352
BindingDB Entry DOI: 10.7270/Q2XP73FM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%