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BDBM50284209 1-Butyl-2,3-dimethyl-1,7-dihydro-5-oxa-1,7-diaza-indene-4,6-dione::CHEMBL174114

SMILES: CCCCn1c(C)c(C)c2c(O)oc(=O)nc12

InChI Key: InChIKey=WJHZPBQEGUWITM-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50284209   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50284209
PNG
(1-Butyl-2,3-dimethyl-1,7-dihydro-5-oxa-1,7-diaza-i...)
Show SMILES CCCCn1c(C)c(C)c2c(O)oc(=O)nc12
Show InChI InChI=1S/C12H16N2O3/c1-4-5-6-14-8(3)7(2)9-10(14)13-12(16)17-11(9)15/h15H,4-6H2,1-3H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

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



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of human leukocyte elastase.


Bioorg Med Chem Lett 4: 949-954 (1994)


Article DOI: 10.1016/S0960-894X(01)80270-5
BindingDB Entry DOI: 10.7270/Q27W6C4C
More data for this
Ligand-Target Pair
Alpha-chymotrypsin


(Bos taurus (bovine))
BDBM50284209
PNG
(1-Butyl-2,3-dimethyl-1,7-dihydro-5-oxa-1,7-diaza-i...)
Show SMILES CCCCn1c(C)c(C)c2c(O)oc(=O)nc12
Show InChI InChI=1S/C12H16N2O3/c1-4-5-6-14-8(3)7(2)9-10(14)13-12(16)17-11(9)15/h15H,4-6H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

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



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of porcine chymotrypsin.


Bioorg Med Chem Lett 4: 949-954 (1994)


Article DOI: 10.1016/S0960-894X(01)80270-5
BindingDB Entry DOI: 10.7270/Q27W6C4C
More data for this
Ligand-Target Pair