BDBM50278459 CHEMBL4176756

SMILES: Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1

InChI Key: InChIKey=XLRHPTGCSRKMLO-CRPIZTHCSA-N

Data: 4 IC50  2 EC50

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 6 hits for monomerid = 50278459   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-A expressed in baculovirus infected insect cells by luminescence assay				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.40	n/a	n/a	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal His/GST-tagged LSD1 (172 to 852 residues) expressed in baculovirus infected insect cells using biotin-labe...				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1B (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Inhibition of human full length LSD2 using biotin-labeled H3K4me2 (1 to 24 residues) as substrate after 1 hr by TR-FRET assay				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.5	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Inhibition of LSD1 in human MV-4-11 cells assessed as increase in CD86 mRNA expression after 10 days by SYBR Green dye-bsed RT-qPCR analysis				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected insect cells by luminescence assay				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50278459 (CHEMBL4176756) Show SMILES Cl.[H][C@]12Cc3ccccc3[C@@]1([H])[C@@]2([H])N[C@@H]1CC[C@H](N)CC1 |r,wD:10.11,2.0,15.16,18.20,12.14,(41.3,-22.41,;36.24,-22.94,;34.76,-22.56,;33.86,-23.81,;32.39,-23.33,;31.06,-24.11,;29.72,-23.34,;29.72,-21.79,;31.05,-21.03,;32.39,-21.79,;33.86,-21.31,;33.84,-19.76,;35.39,-21.15,;36.03,-19.77,;36.92,-21.01,;37.69,-22.33,;39.22,-22.33,;39.99,-23.66,;39.22,-24.99,;39.99,-26.32,;37.69,-24.99,;36.92,-23.67,)| Show InChI InChI=1S/C16H22N2.ClH/c17-11-5-7-12(8-6-11)18-16-14-9-10-3-1-2-4-13(10)15(14)16;/h1-4,11-12,14-16,18H,5-9,17H2;1H/t11-,12+,14-,15+,16-;/m0./s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>20	n/a	n/a	n/a	n/a
East China Normal University Curated by ChEMBL					Assay Description Antagonism of Muscarinic M2 receptors as displacement of concentration response curve of carbachol on isolated guinea-pig left atria				Eur J Med Chem 141: 101-112 (2017) Article DOI: 10.1016/j.ejmech.2017.09.073 BindingDB Entry DOI: 10.7270/Q2474DCP
					More data for this Ligand-Target Pair