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SMILES: COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)C3=CCOCC3)cc(OC)cc2o1

InChI Key: InChIKey=SRNIWQIVVVDOLO-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 2 hits for monomerid = 286474   
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 1


(Homo sapiens (Human))
BDBM286474
PNG
(US9518064, Example 93)
Show SMILES COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)C3=CCOCC3)cc(OC)cc2o1 |t:25|
Show InChI InChI=1S/C26H23N3O5S/c1-30-19-11-22(33-15-16-4-3-5-18(10-16)17-6-8-32-9-7-17)20-13-24(34-23(20)12-19)21-14-29-25(27-21)35-26(28-29)31-2/h3-6,10-14H,7-9,15H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 105n/an/an/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 US9518064 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4SZX
More data for this
Ligand-Target Pair
Proteinase-activated receptor 4


(Homo sapiens (Human))
BDBM286474
PNG
(US9518064, Example 93)
Show SMILES COc1nn2cc(nc2s1)-c1cc2c(OCc3cccc(c3)C3=CCOCC3)cc(OC)cc2o1 |t:25|
Show InChI InChI=1S/C26H23N3O5S/c1-30-19-11-22(33-15-16-4-3-5-18(10-16)17-6-8-32-9-7-17)20-13-24(34-23(20)12-19)21-14-29-25(27-21)35-26(28-29)31-2/h3-6,10-14H,7-9,15H2,1-2H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.710n/an/an/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 US9518064 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4SZX
More data for this
Ligand-Target Pair