Reaction Details Report a problem with these data
Target
Integrin beta
Ligand
BDBM50498781
Substrate
n/a
Meas. Tech.
ChEMBL_1520455 (CHEMBL3624584)
IC50
93100±n/a nM
Citation
 Xie, Z; Feng, S; Wang, Y; Cao, C; Huang, J; Chen, Y; Kong, Y; Li, Z Design, synthesis of novel tryptophan derivatives for antiplatelet aggregation activity based on tripeptide pENW (pGlu-Asn-Trp). Eur J Med Chem 102:363-74 (2015) [PubMed]  Article 
Target
Name:
Integrin beta
Synonyms:
GPIIIa | Integrin beta
Type:
PROTEIN
Mol. Mass.:
87036.04
Organism:
Oryctolagus cuniculus
Description:
ChEMBL_117038
Residue:
788
Sequence:
MRARARPRPLWAAVLALGALAGVGVGGPNICTTRGVSSCQLCLAVSPMCAWCSDEALPVGSPRCDLRENLLQDNCAPESIEFPVSEAQILEARPLSDKGSGDSSQVIQVSPQRIALRLRPDDSKTFSIQVRQVEDYPVDIYYLMDLSYSMKDDLRSIQNLGTKLASQMRKLTSNLRIGFGAFVDKPVSPYMYISPPEALRNPCYDMKTTCLPMFGYKHVLTLTDQVTRFNEEVKKQNVSRNRDAPEGGFDAIMQATVCDEKIGWRNDASHLLVFTTDAKTHIALDGRLAGIVRPNDGQCHIGGDNHYSASTTMDYPSLGLMTEKLSQKNINLIFAVTENVFNLYQNYSELIPGTTVGVLSTNSSNILQLIVDAYGKIRSKVELEVRDLPEELSLSFNATCLNNEVIPGLKSCVGLKIGDTVSFSIEAKVRGCPQEKEKSFTIKPVGFKDSLTVQVTFDCDCACQAHAEPHSHRCNNGNGTFECGVCRCGPGWLGSQCECSEEDYSPSQQDQCSPKEGQPICSQRGECLCGQCVCHSSDFGKITGKYCECDDFSCVRYKGEMCSGHGQCSCGDCLCDSDWTGYYCNCTTRTDTCMSSNGLLCSGRGKCECGSCVCIQPGSYGDTCEKCPTCPDACTFKKECVECKKFERGVLHEENTCSRYCRDEMESVKELRDTGKDAVNCTYKNEDDCVVRFQYYEDSSGKSILYVVEEPECPKGPDILVVLLSVMGAILLIGFALLLIWKLLITIHDRKEFAKFEEERARAKWDTANNPLYKEATSTFTNITYRGT
  
Inhibitor
Name:
BDBM50498781
Synonyms:
CHEMBL3623205
Type:
Small organic molecule
Emp. Form.:
C26H32FN3O5S
Mol. Mass.:
517.613
SMILES:
OC(=O)[C@H](Cc1c[nH]c2ccc(OCCCCC3CCNCC3)cc12)NS(=O)(=O)c1ccc(F)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: