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BDBM285837 (6R,7R,8S)-8-(2,2-difluorovinyl)-4-azaspiro[2.5]octane-6,7-diol::US10081601, Example 19

SMILES: [#8]-[#6@@H]-1-[#6]-[#7]C2([#6]-[#6]2)[#6@H](\[#6]=[#6](\F)F)-[#6@H]-1-[#8]

InChI Key: InChIKey=GYYKXPIHCCASMM-ATRFCDNQSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 285837   
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
Glucosylceramidase


(Homo sapiens (human))
BDBM285837
PNG
((6R,7R,8S)-8-(2,2-difluorovinyl)-4-azaspiro[2.5]oc...)
Show SMILES O[C@@H]1CNC2(CC2)[C@H](C=C(F)F)[C@H]1O
Show InChI InChI=1S/C9H13F2NO2/c10-7(11)3-5-8(14)6(13)4-12-9(5)1-2-9/h3,5-6,8,12-14H,1-2,4H2/t5-,6-,8-/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 75n/an/an/an/a7.0n/a



Alectos Therapeutics Inc.

US Patent


Assay Description
Various concentrations of test compounds were prepared in DMSO and then diluted into buffer consisting of 50 mM sodium phosphate 0.25% w/v sodium tau...


US Patent US10081601 (2018)

More data for this
Ligand-Target Pair