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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thrombin and coagulation factor X' and Ligand = 'BDBM162629'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM162629
PNG
(US9687479, 109 3-(5-[(5-chlorothiophen-2-yl)methyl...)
Show SMILES COCCn1cccc(-c2cc(NCc3ccc(Cl)s3)n(n2)C(=O)c2cccc3OCCOc23)c1=O
Show InChI InChI=1S/C25H23ClN4O5S/c1-33-11-10-29-9-3-5-17(24(29)31)19-14-22(27-15-16-7-8-21(26)36-16)30(28-19)25(32)18-4-2-6-20-23(18)35-13-12-34-20/h2-9,14,27H,10-13,15H2,1H3
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PC cid
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US Patent
n/an/a<100n/an/an/an/a7.425



VERSEON CORPORATION

US Patent


Assay Description
Human thrombin was obtained from Haematologic Technologies Inc. The chromogenic substrate S-2238 was obtained from DiaPharma. Thrombin was assayed in...


US Patent US9687479 (2017)


BindingDB Entry DOI: 10.7270/Q2N29V4R
More data for this
Ligand-Target Pair