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BDBM50159385 (R)-3-[4-(1,1-Dioxo-1,2,3,6-tetrahydro-1lambda*6*-thiopyran-4-yl)-3-fluoro-phenyl]-5-[1,2,3]triazol-1-ylmethyl-oxazolidin-2-one::CHEMBL360048

SMILES: Fc1cc(ccc1C1=CCS(=O)(=O)CC1)N1C[C@H](Cn2ccnn2)OC1=O

InChI Key: InChIKey=SEHNNLNZBWRWKZ-AWEZNQCLSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50159385   
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
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
BDBM50159385
PNG
((R)-3-[4-(1,1-Dioxo-1,2,3,6-tetrahydro-1lambda*6*-...)
Show SMILES Fc1cc(ccc1C1=CCS(=O)(=O)CC1)N1C[C@H](Cn2ccnn2)OC1=O |t:8|
Show InChI InChI=1S/C17H17FN4O4S/c18-16-9-13(1-2-15(16)12-3-7-27(24,25)8-4-12)22-11-14(26-17(22)23)10-21-6-5-19-20-21/h1-3,5-6,9,14H,4,7-8,10-11H2/t14-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.40E+3n/an/an/an/an/an/an/an/a



AstraZeneca Discovery

Curated by ChEMBL


Assay Description
Binding affinity for human liver monoamine oxidase A


J Med Chem 48: 499-506 (2005)


Article DOI: 10.1021/jm0400810
BindingDB Entry DOI: 10.7270/Q2VH5NBS
More data for this
Ligand-Target Pair