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SMILES: COc1cc(OCc2csc(Nc3cc(F)ccc3F)n2)c2cc(oc2c1)-c1cn2nc(C)ccc2n1

InChI Key: InChIKey=NJKPAHMQRWYARR-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 176232   
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
Proteinase-activated receptor 4


(Homo sapiens (Human))
BDBM176232
PNG
(US10047103, 265 | US9688695, 265)
Show SMILES COc1cc(OCc2csc(Nc3cc(F)ccc3F)n2)c2cc(oc2c1)-c1cn2nc(C)ccc2n1
Show InChI InChI=1S/C26H19F2N5O3S/c1-14-3-6-25-30-21(11-33(25)32-14)24-10-18-22(8-17(34-2)9-23(18)36-24)35-12-16-13-37-26(29-16)31-20-7-15(27)4-5-19(20)28/h3-11,13H,12H2,1-2H3,(H,29,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 48n/an/an/a25



BRISTOL-MYERS SQUIBB COMPANY

US Patent


Assay Description
Briefly, HEK293 EBNA PAR4 clone 20664.1J cells were plated 24 hrs. prior to experiment in 384 well, Poly-D-Lysine coated, black, clear bottom plates ...


US Patent US9688695 (2017)


BindingDB Entry DOI: 10.7270/Q28K777N
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM176232
PNG
(US10047103, 265 | US9688695, 265)
Show SMILES COc1cc(OCc2csc(Nc3cc(F)ccc3F)n2)c2cc(oc2c1)-c1cn2nc(C)ccc2n1
Show InChI InChI=1S/C26H19F2N5O3S/c1-14-3-6-25-30-21(11-33(25)32-14)24-10-18-22(8-17(34-2)9-23(18)36-24)35-12-16-13-37-26(29-16)31-20-7-15(27)4-5-19(20)28/h3-11,13H,12H2,1-2H3,(H,29,31)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/a25



Bristol-Myers Squibb Company; Universite de Montreal

US Patent


Assay Description
The ability of the compounds of the current invention to inhibit platelet aggregation induced by gamma-thrombin was tested in a 96-well microplate ag...


US Patent US10047103 (2018)


BindingDB Entry DOI: 10.7270/Q2QF8VWN
More data for this
Ligand-Target Pair
Proteinase-activated receptor 4


(Homo sapiens (Human))
BDBM176232
PNG
(US10047103, 265 | US9688695, 265)
Show SMILES COc1cc(OCc2csc(Nc3cc(F)ccc3F)n2)c2cc(oc2c1)-c1cn2nc(C)ccc2n1
Show InChI InChI=1S/C26H19F2N5O3S/c1-14-3-6-25-30-21(11-33(25)32-14)24-10-18-22(8-17(34-2)9-23(18)36-24)35-12-16-13-37-26(29-16)31-20-7-15(27)4-5-19(20)28/h3-11,13H,12H2,1-2H3,(H,29,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 48n/an/an/a25



Bristol-Myers Squibb Company; Universite de Montreal

US Patent


Assay Description
The activity of the PAR4 antagonists of the present invention were tested in PAR4 expressing cells by monitoring H-Ala-Phe(4-F)-Pro-Gly-Trp-Leu-Val-L...


US Patent US10047103 (2018)


BindingDB Entry DOI: 10.7270/Q2QF8VWN
More data for this
Ligand-Target Pair
Proteinase-activated receptor 4


(Homo sapiens (Human))
BDBM176232
PNG
(US10047103, 265 | US9688695, 265)
Show SMILES COc1cc(OCc2csc(Nc3cc(F)ccc3F)n2)c2cc(oc2c1)-c1cn2nc(C)ccc2n1
Show InChI InChI=1S/C26H19F2N5O3S/c1-14-3-6-25-30-21(11-33(25)32-14)24-10-18-22(8-17(34-2)9-23(18)36-24)35-12-16-13-37-26(29-16)31-20-7-15(27)4-5-19(20)28/h3-11,13H,12H2,1-2H3,(H,29,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>3.00E+3n/an/an/a25



BRISTOL-MYERS SQUIBB COMPANY

US Patent


Assay Description
Briefly, PRP or washed platelet suspension (100 μl) was pre-incubated for 5 minutes at room temperature with varying concentrations of compounds...


US Patent US9688695 (2017)


BindingDB Entry DOI: 10.7270/Q28K777N
More data for this
Ligand-Target Pair