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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific histone demethylase 1A' and Ligand = 'BDBM50278277'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM50278277
PNG
(CHEMBL4169910 | US11352322, Compound 28)
Show SMILES ONC(=O)c1ccc(CNC2CC2c2ccccc2)cc1
Show InChI InChI=1S/C17H18N2O2/c20-17(19-21)14-8-6-12(7-9-14)11-18-16-10-15(16)13-4-2-1-3-5-13/h1-9,15-16,18,21H,10-11H2,(H,19,20)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
LSD1 enzyme was produced in house. Tranylcypromine (TCP), LSD1 inhibitor was procured from Selleckchem. LSD1 enzyme, TCP and Biotinylated peptide sub...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2NS0Z4T
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM50278277
PNG
(CHEMBL4169910 | US11352322, Compound 28)
Show SMILES ONC(=O)c1ccc(CNC2CC2c2ccccc2)cc1
Show InChI InChI=1S/C17H18N2O2/c20-17(19-21)14-8-6-12(7-9-14)11-18-16-10-15(16)13-4-2-1-3-5-13/h1-9,15-16,18,21H,10-11H2,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 4.09E+3n/an/an/an/an/an/a



Xinxiang Medical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant LSD1 (157 to 852 amino acids) (unknown origin) expressed in Escherichia coli BL21(DE) using H3K4me2 substrate by amplex red...


Eur J Med Chem 140: 392-402 (2017)


Article DOI: 10.1016/j.ejmech.2017.09.038
BindingDB Entry DOI: 10.7270/Q2HH6NK6
More data for this
Ligand-Target Pair