Reaction Details |
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Target | E-selectin |
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Ligand | BDBM50215367 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_199713 (CHEMBL802069) |
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IC50 | 90200±n/a nM |
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Citation | TBA Bioorg Med Chem Lett7:985-988 (1997) |
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More Info.: | Get all data from this article, Assay Method |
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E-selectin |
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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
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BDBM50215367 |
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n/a |
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Name | BDBM50215367 |
Synonyms: | CHEMBL3215456 |
Type | Small organic molecule |
Emp. Form. | C49H70N3NaO24 |
Mol. Mass. | 1108.0756 |
SMILES | [Na+].C[C@@H]1O[C@@H](O[C@@H]2[C@H](NC(=O)c3ccc4ccccc4c3)[C@H](OCCCCCCNC(=O)C=C)O[C@@H](CO)[C@H]2O[C@@H]2O[C@@H](CO)[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]2O)[C@@H](O)[C@@H](O)[C@@H]1O |
Structure |
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