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SMILES: C[C@]1(CCCN1C(=O)[C@H]1CCC(=O)N1)C(=O)NCc1cc(Cl)ccc1CN

InChI Key: InChIKey=AQAVXBFPUIDQSJ-BEFAXECRSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 253015   
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))		BDBM253015
PNG
(US9469608, 43)
Show SMILES C[C@]1(CCCN1C(=O)[C@H]1CCC(=O)N1)C(=O)NCc1cc(Cl)ccc1CN |r|
Show InChI InChI=1S/C19H25ClN4O3/c1-19(7-2-8-24(19)17(26)15-5-6-16(25)23-15)18(27)22-11-13-9-14(20)4-3-12(13)10-21/h3-4,9,15H,2,5-8,10-11,21H2,1H3,(H,22,27)(H,23,25)/t15-,19+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 526n/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