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SMILES: OCC(O)Cn1c2ccccc2nc(Cc2ccccc2)c1=O

InChI Key:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50572692   
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
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50572692
PNG
(CHEMBL4878125)
Show SMILES OCC(O)Cn1c2ccccc2nc(Cc2ccccc2)c1=O
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of MMP9 (unknown origin) by colorimetric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113558
BindingDB Entry DOI: 10.7270/Q21R6V95
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50572692
PNG
(CHEMBL4878125)
Show SMILES OCC(O)Cn1c2ccccc2nc(Cc2ccccc2)c1=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of MAO-B (unknown origin) by fluorometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113558
BindingDB Entry DOI: 10.7270/Q21R6V95
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50572692
PNG
(CHEMBL4878125)
Show SMILES OCC(O)Cn1c2ccccc2nc(Cc2ccccc2)c1=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 24n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of MAO-A (unknown origin) by multi-well spectrophotometry


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113558
BindingDB Entry DOI: 10.7270/Q21R6V95
More data for this
Ligand-Target Pair