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BDBM50296286 1-((3S)-1-(2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-oxoethyl)-2-oxoazepan-3-yl)-2-cyano-3-(2-methylbenzofuran-5-yl)guanidine::CHEMBL559785

SMILES: Cc1cc2cc(ccc2o1)N=C(NC#N)N[C@H]1CCCCN(CC(=O)N2CC3CC3C2)C1=O

InChI Key: InChIKey=FIQHROLGLCWVFZ-OQXJIRBTNA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296286   
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
Coagulation factor X


(Homo sapiens (Human))
BDBM50296286
PNG
(1-((3S)-1-(2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-oxo...)
Show SMILES Cc1cc2cc(ccc2o1)N=C(NC#N)N[C@H]1CCCCN(CC(=O)N2CC3CC3C2)C1=O
Show InChI InChI=1/C24H28N6O3/c1-15-8-16-10-19(5-6-21(16)33-15)27-24(26-14-25)28-20-4-2-3-7-29(23(20)32)13-22(31)30-11-17-9-18(17)12-30/h5-6,8,10,17-18,20H,2-4,7,9,11-13H2,1H3,(H2,26,27,28)/t17?,18?,20-/s2
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Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human factor 10a-mediated cleavage of synthetic substrate S-2222


Bioorg Med Chem Lett 19: 4034-41 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.014
BindingDB Entry DOI: 10.7270/Q2TQ61KM
More data for this
Ligand-Target Pair