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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine protease 1' and Ligand = 'BDBM234251'   
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
Serine protease 1


(Homo sapiens (Human))
BDBM234251
PNG
(US9346821, B-21)
Show SMILES NC(=N)c1ccc(OC(=O)c2ccc(CN3CSC[C@H]3C(=O)N(CC=C)CC(O)=O)s2)c(F)c1 |r|
Show InChI InChI=1S/C22H23FN4O5S2/c1-2-7-26(10-19(28)29)21(30)16-11-33-12-27(16)9-14-4-6-18(34-14)22(31)32-17-5-3-13(20(24)25)8-15(17)23/h2-6,8,16H,1,7,9-12H2,(H3,24,25)(H,28,29)/t16-/m0/s1
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MMDB

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PC cid
PC sid
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US Patent
0.380n/an/an/an/an/an/a8.0n/a



AJINOMOTO CO., INC.

US Patent


Assay Description
Using a 96 well plate (#3915, Costar), a test compound (25 μL), 400 mM Tris-HCl buffer (pH 8.0, 25 μL) and 0.5 mg/mL fluorescence enzyme su...


US Patent US9346821 (2016)


BindingDB Entry DOI: 10.7270/Q2RB73G2
More data for this
Ligand-Target Pair