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BDBM253009 US9469608, 37-11a

SMILES: CC1(C)C[C@@]1(O)C(=O)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1CN

InChI Key: InChIKey=PTQZRJVGJCTSIV-HNAYVOBHSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 253009   
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
Prothrombin


(Homo sapiens (Human))
BDBM253009
PNG
(US9469608, 37-11a)
Show SMILES CC1(C)C[C@@]1(O)C(=O)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1CN |r|
Show InChI InChI=1S/C19H26ClN3O3/c1-18(2)11-19(18,26)17(25)23-7-3-4-15(23)16(24)22-10-13-8-14(20)6-5-12(13)9-21/h5-6,8,15,26H,3-4,7,9-11,21H2,1-2H3,(H,22,24)/t15-,19+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
720n/an/an/an/an/an/a7.4n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Relevant in vitro assays are referenced in Morrissette, et al., Bioorg. Med. Chem. Lett. 2004, 14, 4161-4164 and described in Lewis, et al. Thromb. R...


US Patent US9469608 (2016)


BindingDB Entry DOI: 10.7270/Q2F18XNQ
More data for this
Ligand-Target Pair