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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific histone demethylase 2 (LSD2)' AND taxid = 10090   
Target
(Institution)
LigandTarget
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 2 (LSD2)


(Mus musculus (Mouse))
BDBM124969
PNG
(US8765820, 6l)
Show SMILES NC1CC1c1ccc(NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)COc2ccccc2)cc1
Show InChI InChI=1S/C28H28N4O3/c29-24-15-23(24)18-10-12-20(13-11-18)31-28(34)26(14-19-16-30-25-9-5-4-8-22(19)25)32-27(33)17-35-21-6-2-1-3-7-21/h1-13,16,23-24,26,30H,14-15,17,29H2,(H,31,34)(H,32,33)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
1.20E+4n/an/an/an/an/an/an/an/a



Universita Degli Studi di Roma “La Sapienza”; Fondazione IEO; Universita Degli Studi di Pavia; Universita Degli Studi di Milano

US Patent


Assay Description
Human recombinant MAO A and MAO B were expressed in Pichia pastoris and purified as published (Binda C, et al., Proc. Natl. Acad. Sci. USA 100: 9750-...


US Patent US8765820 (2014)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 2 (LSD2)


(Mus musculus (Mouse))
BDBM50346586
PNG
(CHEMBL1795981 | US8765820, 5a)
Show SMILES NC1CC1c1ccc(NC(=O)OCc2ccccc2)cc1
Show InChI InChI=1S/C17H18N2O2/c18-16-10-15(16)13-6-8-14(9-7-13)19-17(20)21-11-12-4-2-1-3-5-12/h1-9,15-16H,10-11,18H2,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
US Patent
2.00E+4n/an/an/an/an/an/an/an/a



Universita Degli Studi di Roma “La Sapienza”; Fondazione IEO; Universita Degli Studi di Pavia; Universita Degli Studi di Milano

US Patent


Assay Description
Human recombinant MAO A and MAO B were expressed in Pichia pastoris and purified as published (Binda C, et al., Proc. Natl. Acad. Sci. USA 100: 9750-...


US Patent US8765820 (2014)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 2 (LSD2)


(Mus musculus (Mouse))
BDBM50346864
PNG
(CHEMBL1797641 | CHEMBL3104337 | US8765820, 8)
Show SMILES NC1CC1c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)OCc2ccccc2)cc1
Show InChI InChI=1S/C26H27N3O3/c27-23-16-22(23)20-11-13-21(14-12-20)28-25(30)24(15-18-7-3-1-4-8-18)29-26(31)32-17-19-9-5-2-6-10-19/h1-14,22-24H,15-17,27H2,(H,28,30)(H,29,31)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
2.00E+4n/an/an/an/an/an/an/an/a



Universita Degli Studi di Roma “La Sapienza”; Fondazione IEO; Universita Degli Studi di Pavia; Universita Degli Studi di Milano

US Patent


Assay Description
Human recombinant MAO A and MAO B were expressed in Pichia pastoris and purified as published (Binda C, et al., Proc. Natl. Acad. Sci. USA 100: 9750-...


US Patent US8765820 (2014)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 2 (LSD2)


(Mus musculus (Mouse))
BDBM124968
PNG
(US8765820, 6e)
Show SMILES NC1CC1c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)COc2ccccc2)cc1
Show InChI InChI=1S/C26H27N3O3/c27-23-16-22(23)19-11-13-20(14-12-19)28-26(31)24(15-18-7-3-1-4-8-18)29-25(30)17-32-21-9-5-2-6-10-21/h1-14,22-24H,15-17,27H2,(H,28,31)(H,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
3.80E+4n/an/an/an/an/an/an/an/a



Universita Degli Studi di Roma “La Sapienza”; Fondazione IEO; Universita Degli Studi di Pavia; Universita Degli Studi di Milano

US Patent


Assay Description
Human recombinant MAO A and MAO B were expressed in Pichia pastoris and purified as published (Binda C, et al., Proc. Natl. Acad. Sci. USA 100: 9750-...


US Patent US8765820 (2014)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 2 (LSD2)


(Mus musculus (Mouse))
BDBM50346863
PNG
(CHEMBL1797640 | US8765820, 5b)
Show SMILES NC1CC1c1ccc(NC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C16H16N2O/c17-15-10-14(15)11-6-8-13(9-7-11)18-16(19)12-4-2-1-3-5-12/h1-9,14-15H,10,17H2,(H,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
6.10E+4n/an/an/an/an/an/an/an/a



Universita Degli Studi di Roma “La Sapienza”; Fondazione IEO; Universita Degli Studi di Pavia; Universita Degli Studi di Milano

US Patent


Assay Description
Human recombinant MAO A and MAO B were expressed in Pichia pastoris and purified as published (Binda C, et al., Proc. Natl. Acad. Sci. USA 100: 9750-...


US Patent US8765820 (2014)

More data for this
Ligand-Target Pair