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Target
E-selectin
Ligand
BDBM50450369
Substrate
n/a
Meas. Tech.
ChEBML_199876
IC50
3000000±n/a nM
Citation
 Dupré, B; Bui, H; Scott, IL; Market, RV; Keller, KM; Beck, PJ; Kogan, TP Glycomimetic selectin inhibitors: (α-D-mannopyranosyloxy)methylbiphenyls Bioorg Med Chem Lett 6:569-572 (1996)    Article 
Target
Name:
E-selectin
Synonyms:
Elam-1 | LYAM2_MOUSE | Sele | Selectin E
Type:
PROTEIN
Mol. Mass.:
66749.86
Organism:
Mus musculus
Description:
ChEMBL_199837
Residue:
612
Sequence:
MNASRFLSALVFVLLAGESTAWYYNASSELMTYDEASAYCQRDYTHLVAIQNKEEINYLNSNLKHSPSYYWIGIRKVNNVWIWVGTGKPLTEEAQNWAPGEPNNKQRNEDCVEIYIQRTKDSGMWNDERCNKKKLALCYTASCTNASCSGHGECIETINSYTCKCHPGFLGPNCEQAVTCKPQEHPDYGSLNCSHPFGPFSYNSSCSFGCKRGYLPSSMETTVRCTSSGEWSAPAPACHVVECEALTHPAHGIRKCSSNPGSYPWNTTCTFDCVEGYRRVGAQNLQCTSSGIWDNETPSCKAVTCDAIPQPQNGFVSCSHSTAGELAFKSSCNFTCEQSFTLQGPAQVECSAQGQWTPQIPVCKAVQCEALSAPQQGNMKCLPSASGPFQNGSSCEFSCEEGFELKGSRRLQCGPRGEWDSKKPTCSAVKCDDVPRPQNGVMECAHATTGEFTYKSSCAFQCNEGFSLHGSAQLECTSQGKWTQEVPSCQVVQCPSLDVPGKMNMSCSGTAVFGTVCEFTCPDDWTLNGSAVLTCGATGRWSGMPPTCEAPVSPTRPLVVALSAAGTSLLTSSSLLYLLMRYFRKKAKKFVPASSCQSLQSFENYHVPSYNV
  
Inhibitor
Name:
BDBM50450369
Synonyms:
SIALYL LEWIS X | Sialyl LeX | Sialyl lewis-x | sLex | sialyl LewisX
Type:
Small organic molecule
Emp. Form.:
C31H52N2O23
Mol. Mass.:
820.7442
SMILES:
[H][C@]1(O[C@@](C[C@H](O)[C@H]1NC(C)=O)(O[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]([C@H](O)CO)[C@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](NC(C)=O)C=O)[C@@H]1O)C(O)=O)[C@H](O)[C@H](O)CO
Structure:
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