Table 1: Nineteen target proteins in pathway network of platelet aggregation.

Protein nameUniprotPDBLigandbScorec

Adenylate cyclaseO602661AB81AB86.38
Glycoprotein IIb/IIIa complexP051062VDM2VDM5.29
Inositol 1,4,5-trisphosphate receptorQ146431N4K1N4K9.14
P2X purinoceptor 1P515754DW14DW15.20
P2Y purinoceptor 1P479001Y36AMP5.38
P2Y purinoceptor 12Q9H2441T78AMP3.84
Proteinase-activated receptor 1P25116ModelaF163575.38
Proteinase-activated receptor 4Q96RI0ModelaYD34.28
phosphatidylinositol 3-kinaseP487364FUL4FUL6.78
RAC-alpha serine/threonine-protein kinaseP317513D0E3D0E5.39
Protein kinase CP172523IW43IW46.89
Phospholipase A2P145551J1A1J1A5.22
Phosphoinositide phospholipase C beta-2Q007222ZKMU731225.62
Phosphoinositide phospholipase C gamma-2P168852W2WU731225.00
Prostaglandin G/H synthase 1P232193N8X3N8X5.05
Ras-related proteinQ9H0U43NKV3NKV5.30
ThrombinP007343DUX3DUX5.02
Thromboxane A2 receptor alphaP217311LBNSQ295487.90
Thromboxane A2 receptor betaP217311LBNSQ295487.90

aThe structures of targets PAR1 and PAR4 were prepared by homology modeling based on crystal structure of bovine rhodopsin (PDB entry: 1U19).
bIf the ligand was equal to the PDB entry, the structure was a ligand-protein complex; otherwise the reference ligand was a known inhibitor.
cDocking score of reference ligand for each target protein.