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SMILES: CC(C)(C)[C@@H](N)C(=O)N1CC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N

InChI Key:

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 2 hits for monomerid = 594978   
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
thrombin


(Homo sapiens (Human))
BDBM594978
PNG
(US11584714, Compound 1005)
Show SMILES CC(C)(C)[C@@H](N)C(=O)N1CC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
<500n/an/an/an/an/an/an/an/a


TBA

Assay Description
The thrombin assay utilizes a fluorogenic peptide substrate (Boc-VPR-AMC (R&D Systems) and was run at room temperature in an assay buffer containing ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2VH5SRT
More data for this
Ligand-Target Pair
Mannan-binding lectin serine protease 2


(Homo sapiens)
BDBM594978
PNG
(US11584714, Compound 1005)
Show SMILES CC(C)(C)[C@@H](N)C(=O)N1CC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
6.25E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
The assay was run at room temperature in an assay buffer containing 20 mM Hepes, pH 7.4, 140 mM NaCl and 0.1% Tween 20. Assay parameters were adjuste...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2VH5SRT
More data for this
Ligand-Target Pair