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BDBM50422883 CHEMBL213724

SMILES: Cc1c(C)c(=O)oc2cc(CCc3ccccc3)ccc12

InChI Key: InChIKey=JGJJYTJJKXNVSH-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50422883   
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
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50422883
PNG
(CHEMBL213724)
Show SMILES Cc1c(C)c(=O)oc2cc(CCc3ccccc3)ccc12
Show InChI InChI=1S/C19H18O2/c1-13-14(2)19(20)21-18-12-16(10-11-17(13)18)9-8-15-6-4-3-5-7-15/h3-7,10-12H,8-9H2,1-2H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.08E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of Sprague-Dawley rat brain mitochondria MAOA by continuous spectrophotometric assay


J Med Chem 49: 4912-25 (2006)


Article DOI: 10.1021/jm060183l
BindingDB Entry DOI: 10.7270/Q2CV4K1N
More data for this
Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B)


(Rattus norvegicus (rat))
BDBM50422883
PNG
(CHEMBL213724)
Show SMILES Cc1c(C)c(=O)oc2cc(CCc3ccccc3)ccc12
Show InChI InChI=1S/C19H18O2/c1-13-14(2)19(20)21-18-12-16(10-11-17(13)18)9-8-15-6-4-3-5-7-15/h3-7,10-12H,8-9H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 457n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of Sprague-Dawley rat brain mitochondria MAOB by continuous spectrophotometric assay


J Med Chem 49: 4912-25 (2006)


Article DOI: 10.1021/jm060183l
BindingDB Entry DOI: 10.7270/Q2CV4K1N
More data for this
Ligand-Target Pair