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Target
P-selectin
Ligand
BDBM50614401
Substrate
n/a
Meas. Tech.
ChEMBL_2296898
IC50
150±n/a nM
Citation
 Jia, L; Ma, S Recent advances in the discovery of heparanase inhibitors as anti-cancer agents. Eur J Med Chem 121:209-220 (2016) [PubMed] 
Target
Name:
P-selectin
Synonyms:
CD62 antigen-like family member P | CD_antigen=CD62P | GMP-140 | Granule membrane protein 140 | Grmp | LECAM3 | LYAM3_MOUSE | Leukocyte-endothelial cell adhesion molecule 3 | PADGEM | Selp
Type:
PROTEIN
Mol. Mass.:
83091.41
Organism:
Mus musculus
Description:
ChEMBL_200024
Residue:
768
Sequence:
MAGCPKGSWTPRLRSVILGGAQLIWFSALISELVNQKEVAAWTYNYSTKAYSWNNSRVFCRRHFTDLVAIQNKNEIAHLNDVIPFFNSYYWIGIRKINNKWTWVGTNKTLTEEAENWADNEPNNKKNNQDCVEIYIKSNSAPGKWNDEPCFKRKRALCYTASCQDMSCSNQGECIETIGSYTCSCYPGFYGPECEYVKECGKVNIPQHVLMNCSHPLGEFSFNSQCTFSCAEGYELDGPGELQCLASGIWTNNPPKCDAVQCQSLEAPPHGTMACMHPIAAFAYDSSCKFECQPGYRARGSNTLHCTGSGQWSEPLPTCEAIACEPPEIPIHGSMDCVPSTGTFGYNSSCTFLCAEGFVLKGNDAIQCADSGQWTAPAPFCEALQCPEFPVPSKAQVNCSDPFGTLTYQSVCSFSCDEGSLLVGASVIRCLATGHWNGAPPECQAVSCAPMLSPENGSMTCVQPLGNSTYKSTCQFMCDEGFYLSGPERLDCSPSGHWTGTPPTCEAIKCPGIFAPEQGNLDCSHVHGEFGVGSICHFSCNEDFELLGSENVECTVSGRWSAPPPTCKGITSLPAPAVRCPALTTPGQGTMSCQHHLGSFGPNTTCYFGCKTGFTLRGANSLRCRASGQWTAVTPMCRAVKCSELHMDTAVAMNCSNPWGNFSYGSTCTFQCPEGQSLNGSVRATCREDGHWSDAMPTCQAGTLTIQEALTYLGGAVASTTGLAVGGTLLALLRKRLRKKDDGKCPLNPHSHLGTYGVFTNAAYDPTP
  
Inhibitor
Name:
BDBM50614401
Synonyms:
CHEMBL5269532
Type:
Small organic molecule
Emp. Form.:
C36H62O90S20
Mol. Mass.:
2576.123
SMILES:
[H][C@@]1(O[C@H]2[C@H](COS(O)(=O)=O)OC([C@@H](OS(O)(=O)=O)[C@@H]2OS(O)(=O)=O)C2O[C@H](COS(O)(=O)=O)[C@@]([H])(O[C@H]3O[C@H](COS(O)(=O)=O)[C@@]([H])(O[C@H]4O[C@H](COS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]4OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]3OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]2OS(O)(=O)=O)O[C@@H](COS(O)(=O)=O)[C@H](O[C@]2([H])O[C@@H](COS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@@H]2OS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@@H]1OS(O)(=O)=O |r|
Structure:
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