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BDBM50436926 CHEMBL2402114

SMILES: CO[C@]1(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O1)[C@H](O)[C@H](O)CCP(O)(O)=O)C(O)=O

InChI Key: InChIKey=NGFVOSJQZXNHAE-XAGGSGLKSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436926   
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
N-acylneuraminate-9-phosphatase


(Homo sapiens (Human))
BDBM50436926
PNG
(CHEMBL2402114)
Show SMILES CO[C@]1(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O1)[C@H](O)[C@H](O)CCP(O)(O)=O)C(O)=O |r|
Show InChI InChI=1S/C13H24NO11P/c1-6(15)14-9-8(17)5-13(24-2,12(19)20)25-11(9)10(18)7(16)3-4-26(21,22)23/h7-11,16-18H,3-5H2,1-2H3,(H,14,15)(H,19,20)(H2,21,22,23)/t7-,8+,9-,10-,11-,13+/m1/s1
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PC sid
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Similars

Article
PubMed
n/an/a 4.98E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of recombinant HDHD4 (unknown origin) using Neu5Ac-9-P as substrate assessed as release of phosphate after 30 mins by maiachite green assa...


Bioorg Med Chem Lett 23: 4107-11 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.052
BindingDB Entry DOI: 10.7270/Q2TB1897
More data for this
Ligand-Target Pair