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BDBM50078898 CHEMBL3416429

SMILES: Cl.N[C@@H]1C[C@H]1c1cccc(NC(=O)c2ccccc2)c1

InChI Key: InChIKey=LWZOXNDYTWHCNC-LSDHHAIUSA-N

Data: 3 IC50

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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 = 50078898   
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))
BDBM50078898
PNG
(CHEMBL3416429)
Show SMILES Cl.N[C@@H]1C[C@H]1c1cccc(NC(=O)c2ccccc2)c1 |r|
Show InChI InChI=1S/C16H16N2O/c17-15-10-14(15)12-7-4-8-13(9-12)18-16(19)11-5-2-1-3-6-11/h1-9,14-15H,10,17H2,(H,18,19)/t14-,15+/m0/s1
PDB

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UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
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Article
PubMed
n/an/a 1.54E+3n/an/an/an/an/an/a



Sapienza University of Roma

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA expressed in Pichia pastoris incubated for 15 mins prior to substrate addition measured after 30 mins by lumines...


Eur J Med Chem 94: 163-74 (2015)


Article DOI: 10.1016/j.ejmech.2015.02.060
BindingDB Entry DOI: 10.7270/Q2JQ12QF
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM50078898
PNG
(CHEMBL3416429)
Show SMILES Cl.N[C@@H]1C[C@H]1c1cccc(NC(=O)c2ccccc2)c1 |r|
Show InChI InChI=1S/C16H16N2O/c17-15-10-14(15)12-7-4-8-13(9-12)18-16(19)11-5-2-1-3-6-11/h1-9,14-15H,10,17H2,(H,18,19)/t14-,15+/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
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UniChem

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Article
PubMed
n/an/a 1.09E+4n/an/an/an/an/an/a



Sapienza University of Roma

Curated by ChEMBL


Assay Description
Inhibition of human recombinant LSD1 expressed in Escherichia coli using methylated H3K4peptide as substrate incubated for 15 mins prior to substrate...


Eur J Med Chem 94: 163-74 (2015)


Article DOI: 10.1016/j.ejmech.2015.02.060
BindingDB Entry DOI: 10.7270/Q2JQ12QF
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50078898
PNG
(CHEMBL3416429)
Show SMILES Cl.N[C@@H]1C[C@H]1c1cccc(NC(=O)c2ccccc2)c1 |r|
Show InChI InChI=1S/C16H16N2O/c17-15-10-14(15)12-7-4-8-13(9-12)18-16(19)11-5-2-1-3-6-11/h1-9,14-15H,10,17H2,(H,18,19)/t14-,15+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.47E+4n/an/an/an/an/an/a



Sapienza University of Roma

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in Pichia pastoris incubated for 15 mins prior to substrate addition measured after 30 mins by lumines...


Eur J Med Chem 94: 163-74 (2015)


Article DOI: 10.1016/j.ejmech.2015.02.060
BindingDB Entry DOI: 10.7270/Q2JQ12QF
More data for this
Ligand-Target Pair