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SMILES: O[C@@H]1[C@@H](CCP(O)(O)=O)O[C@H](Oc2ccc(NC(=O)NCCCCc3cn(CCCCC(NC(=O)[C@@H](CCCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)NC(=O)C(CCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)N(=O)CCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)C(=O)NCCOCCOCCOCCOCCC(O)=O)nn3)cc2)[C@@H](O)[C@H]1O

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 582013   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cation-dependent mannose-6-phosphate receptor


(Homo sapiens (Human))
BDBM582013
PNG
(WO2023288015, Compound Table12B.772)
Show SMILES O[C@@H]1[C@@H](CCP(O)(O)=O)O[C@H](Oc2ccc(NC(=O)NCCCCc3cn(CCCCC(NC(=O)[C@@H](CCCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)NC(=O)C(CCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)N(=O)CCCn4cc(CCCCNC(=O)Nc5ccc(O[C@H]6O[C@H](CCP(O)(O)=O)[C@@H](O)[C@H](O)[C@@H]6O)cc5)nn4)C(=O)NCCOCCOCCOCCOCCC(O)=O)nn3)cc2)[C@@H](O)[C@H]1O
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
WIPO WO2023288015
n/an/a 75n/an/an/an/an/an/a


TBA

Assay Description
M6PR binding was measured in black 96-well plates using a fluorescence polarization assay. A fluorescent probe consisting of a reference M6Pn ligand ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2TX3K67
More data for this
Ligand-Target Pair