BindingDB logo
myBDB logout

BDBM50349391 CHEMBL1808528

SMILES: FC(F)(F)COC(=O)c1nn(C(=O)c2ccccc2)c2ccccc12

InChI Key: InChIKey=VRSNFZZDYDJHIZ-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50349391   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prothrombin


(Homo sapiens (Human))
BDBM50349391
PNG
(CHEMBL1808528)
Show SMILES FC(F)(F)COC(=O)c1nn(C(=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C17H11F3N2O3/c18-17(19,20)10-25-16(24)14-12-8-4-5-9-13(12)22(21-14)15(23)11-6-2-1-3-7-11/h1-9H,10H2
PDB

Reactome pathway

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.70E+3n/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human plasma thrombin benzoyl-Phe-Val-Arg-7-amino-4-methylcoumarin as substrate by spectrophotometric analysis


Bioorg Med Chem 19: 4460-72 (2011)


Article DOI: 10.1016/j.bmc.2011.06.036
BindingDB Entry DOI: 10.7270/Q2JD4X5N
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50349391
PNG
(CHEMBL1808528)
Show SMILES FC(F)(F)COC(=O)c1nn(C(=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C17H11F3N2O3/c18-17(19,20)10-25-16(24)14-12-8-4-5-9-13(12)22(21-14)15(23)11-6-2-1-3-7-11/h1-9H,10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 260n/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human neutrophil elastase using N-methylsuccinyl-Ala-Ala-Pro-Val-7-amino-4-methyl-coumarin as substrate measured every 30 secs for 10 m...


Bioorg Med Chem 19: 4460-72 (2011)


Article DOI: 10.1016/j.bmc.2011.06.036
BindingDB Entry DOI: 10.7270/Q2JD4X5N
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50349391
PNG
(CHEMBL1808528)
Show SMILES FC(F)(F)COC(=O)c1nn(C(=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C17H11F3N2O3/c18-17(19,20)10-25-16(24)14-12-8-4-5-9-13(12)22(21-14)15(23)11-6-2-1-3-7-11/h1-9H,10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human urine urokinase using benzyloxycarbonyl-Gly-Gly-Arg-7-amino-4-methylcoumarin as substrate by spectrophotometric analysis


Bioorg Med Chem 19: 4460-72 (2011)


Article DOI: 10.1016/j.bmc.2011.06.036
BindingDB Entry DOI: 10.7270/Q2JD4X5N
More data for this
Ligand-Target Pair