Ki Summary

Reaction Details

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Target

E-selectin

Ligand

BDBM50050458

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_60884 (CHEMBL673531)

IC50

360000±n/a nM

Citation

Ohmoto, H; Nakamura, K; Inoue, T; Kondo, N; Inoue, Y; Yoshino, K; Kondo, H; Ishida, H; Kiso, M; Hasegawa, A Studies on selectin blocker. 1. Structure-activity relationships of sialyl Lewis X analogs. J Med Chem39:1339-43 (1996) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

E-selectin

Name:

E-selectin

Synonyms:

ELAM1 | LYAM2_HUMAN | SELE | Selectin | Selectin E

Type:

PROTEIN

Mol. Mass.:

66642.96

Organism:

Homo sapiens (Human)

Description:

ChEMBL_1438995

Residue:

610

Sequence:

MIASQFLSALTLVLLIKESGAWSYNTSTEAMTYDEASAYCQQRYTHLVAIQNKEEIEYLN
SILSYSPSYYWIGIRKVNNVWVWVGTQKPLTEEAKNWAPGEPNNRQKDEDCVEIYIKREK
DVGMWNDERCSKKKLALCYTAACTNTSCSGHGECVETINNYTCKCDPGFSGLKCEQIVNC
TALESPEHGSLVCSHPLGNFSYNSSCSISCDRGYLPSSMETMQCMSSGEWSAPIPACNVV
ECDAVTNPANGFVECFQNPGSFPWNTTCTFDCEEGFELMGAQSLQCTSSGNWDNEKPTCK
AVTCRAVRQPQNGSVRCSHSPAGEFTFKSSCNFTCEEGFMLQGPAQVECTTQGQWTQQIP
VCEAFQCTALSNPERGYMNCLPSASGSFRYGSSCEFSCEQGFVLKGSKRLQCGPTGEWDN
EKPTCEAVRCDAVHQPPKGLVRCAHSPIGEFTYKSSCAFSCEEGFELHGSTQLECTSQGQ
WTEEVPSCQVVKCSSLAVPGKINMSCSGEPVFGTVCKFACPEGWTLNGSAARTCGATGHW
SGLLPTCEAPTESNIPLVAGLSAAGLSLLTLAPFLLWLRKCLRKAKKFVPASSCQSLESD
GSYQKPSYIL

BDBM50050458

n/a

Name

BDBM50050458

Synonyms:

5-Acetylamino-2-{3,5-dihydroxy-2-hydroxymethyl-6-[2-hydroxymethyl-4-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-3-yloxy]-tetrahydro-pyran-4-yloxy}-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxy-propyl)-tetrahydro-pyran-2-carboxylic acid | CHEMBL367520

Type

Small organic molecule

Emp. Form.

C28H47NO21

Mol. Mass.

733.6669

SMILES

C[C@@H]1O[C@@H](O[C@@H]2CCO[C@H](CO)[C@H]2O[C@@H]2O[C@H](O)[C@H](O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O3)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O

Structure