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BDBM124969 US8765820, 6l

SMILES: NC1CC1c1ccc(NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)COc2ccccc2)cc1

InChI Key: InChIKey=GJHOCVJIBHITPR-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 124969   
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
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
US Patent
1.20E+4n/an/an/an/an/an/a7.5n/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)


BindingDB Entry DOI: 10.7270/Q20P0XPN
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
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

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
4.00E+4n/an/an/an/an/an/a7.5n/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)


BindingDB Entry DOI: 10.7270/Q20P0XPN
More data for this
Ligand-Target Pair
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
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

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
4.90E+4n/an/an/an/an/an/a7.5n/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)


BindingDB Entry DOI: 10.7270/Q20P0XPN
More data for this
Ligand-Target Pair