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SMILES: OC1C(CCP(O)(O)=O)OC(Oc2ccc(NC(=O)NCCCCc3cn(CCCCC(NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)CCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)C(=O)NCCOCCOCCOCCOCCC(=O)c4c(F)c(F)c(F)c(F)c4F)nn3)cc2)C(O)C1O

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 582017   
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))
BDBM582017
PNG
(WO2023288015, Compound Table12B.775)
Show SMILES OC1C(CCP(O)(O)=O)OC(Oc2ccc(NC(=O)NCCCCc3cn(CCCCC(NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)C(CCCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)NC(=O)CCCn4cc(CCCCNC(=O)Nc5ccc(OC6OC(CCP(O)(O)=O)C(O)C(O)C6O)cc5)nn4)C(=O)NCCOCCOCCOCCOCCC(=O)c4c(F)c(F)c(F)c(F)c4F)nn3)cc2)C(O)C1O
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
WIPO WO2023288015
n/an/a<50n/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