BindingDB logo
myBDB logout

null

SMILES: NC(=O)[C@@H]1CCCN1Cc1cc(=O)oc2cc(OCc3cccc(F)c3)ccc12

InChI Key: InChIKey=SRLMYQWBLKPDRC-IBGZPJMESA-N

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 2 hits for monomerid = 50299421   
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] B


(Rattus norvegicus (rat))
BDBM50299421
PNG
(1-({7-[(3-Fluorobenzyl)oxy]-2-oxo-2H-chromen-4-yl}...)
Show SMILES NC(=O)[C@@H]1CCCN1Cc1cc(=O)oc2cc(OCc3cccc(F)c3)ccc12 |r|
Show InChI InChI=1S/C22H21FN2O4/c23-16-4-1-3-14(9-16)13-28-17-6-7-18-15(10-21(26)29-20(18)11-17)12-25-8-2-5-19(25)22(24)27/h1,3-4,6-7,9-11,19H,2,5,8,12-13H2,(H2,24,27)/t19-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 850n/an/an/an/an/an/a



Universita degli Studi di Bari

Curated by ChEMBL


Assay Description
Inhibition of MAO-B from Wistar rat brain by radioenzymatic assay


J Med Chem 52: 6685-706 (2009)


Article DOI: 10.1021/jm9010127
BindingDB Entry DOI: 10.7270/Q2DR2VJ6
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Rattus norvegicus (rat))
BDBM50299421
PNG
(1-({7-[(3-Fluorobenzyl)oxy]-2-oxo-2H-chromen-4-yl}...)
Show SMILES NC(=O)[C@@H]1CCCN1Cc1cc(=O)oc2cc(OCc3cccc(F)c3)ccc12 |r|
Show InChI InChI=1S/C22H21FN2O4/c23-16-4-1-3-14(9-16)13-28-17-6-7-18-15(10-21(26)29-20(18)11-17)12-25-8-2-5-19(25)22(24)27/h1,3-4,6-7,9-11,19H,2,5,8,12-13H2,(H2,24,27)/t19-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universita degli Studi di Bari

Curated by ChEMBL


Assay Description
Inhibition of MAO-A from Wistar rat brain by radioenzymatic assay


J Med Chem 52: 6685-706 (2009)


Article DOI: 10.1021/jm9010127
BindingDB Entry DOI: 10.7270/Q2DR2VJ6
More data for this
Ligand-Target Pair