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Target
P-selectin
Ligand
BDBM50061135
Substrate
n/a
Meas. Tech.
ChEMBL_200027 (CHEMBL810716)
IC50
1300±n/a nM
Citation
Marinier, A; Martel, A; Banville, J; Bachand, C; Remillard, R; Lapointe, P; Turmel, B; Menard, M; Harte, WE; Wright, JJ; Todderud, G; Tramposch, KM; Bajorath, J; Hollenbaugh, D; Aruffo, A Sulfated galactocerebrosides as potential antiinflammatory agents. J Med Chem 40:3234-47 (1997) [PubMed] Article
More Info.:
Target
Name:
P-selectin
Synonyms:
GMRP | GRMP | LYAM3_HUMAN | P-selectin | P-selectin/P-selectin glycoprotein ligand 1 | SELP
Type:
PROTEIN
Mol. Mass.:
90834.61
Organism:
Human
Description:
ChEMBL_1438999
Residue:
830
Sequence:
MANCQIAILYQRFQRVVFGISQLLCFSALISELTNQKEVAAWTYHYSTKAYSWNISRKYCQNRYTDLVAIQNKNEIDYLNKVLPYYSSYYWIGIRKNNKTWTWVGTKKALTNEAENWADNEPNNKRNNEDCVEIYIKSPSAPGKWNDEHCLKKKHALCYTASCQDMSCSKQGECLETIGNYTCSCYPGFYGPECEYVRECGELELPQHVLMNCSHPLGNFSFNSQCSFHCTDGYQVNGPSKLECLASGIWTNKPPQCLAAQCPPLKIPERGNMTCLHSAKAFQHQSSCSFSCEEGFALVGPEVVQCTASGVWTAPAPVCKAVQCQHLEAPSEGTMDCVHPLTAFAYGSSCKFECQPGYRVRGLDMLRCIDSGHWSAPLPTCEAISCEPLESPVHGSMDCSPSLRAFQYDTNCSFRCAEGFMLRGADIVRCDNLGQWTAPAPVCQALQCQDLPVPNEARVNCSHPFGAFRYQSVCSFTCNEGLLLVGASVLQCLATGNWNSVPPECQAIPCTPLLSPQNGTMTCVQPLGSSSYKSTCQFICDEGYSLSGPERLDCTRSGRWTDSPPMCEAIKCPELFAPEQGSLDCSDTRGEFNVGSTCHFSCDNGFKLEGPNNVECTTSGRWSATPPTCKGIASLPTPGLQCPALTTPGQGTMYCRHHPGTFGFNTTCYFGCNAGFTLIGDSTLSCRPSGQWTAVTPACRAVKCSELHVNKPIAMNCSNLWGNFSYGSICSFHCLEGQLLNGSAQTACQENGHWSTTVPTCQAGPLTIQEALTYFGGAVASTIGLIMGGTLLALLRKRFRQKDDGKCPLNPHSHLGTYGVFTNAAFDPSP
Inhibitor
Name:
BDBM50061135
Synonyms:
(2S,3R,4E)-3-(Benzoyloxy)-2-(hexadecanoylamino)-1-[[2-O-benzoyl-4-O-acetyl-3,6-bis-O-(sodium oxysulfonyl)-beta-D-galactopyranosyl]oxy]-4-octadecene | CHEMBL217745
Type:
Small organic molecule
Emp. Form.:
C56H89NO15S2
Mol. Mass.:
1080.435
SMILES:
CCCCCCCCCCCCCCCC(=O)N[C@@H](COC1OC(COS([O-])(=O)=O)C(OC(C)=O)C(OS([O-])(=O)=O)C1OCc1ccccc1)[C@H](OCc1ccccc1)\C=C\CCCCCCCCCCCCC