BDBM111190 US10112950, Example 42::US10556908, Example 42::US9695180, 42

SMILES: CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N

InChI Key: InChIKey=UUNQTJAQDFYPHC-OAQYLSRUSA-N

Data: 3 IC50

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 = 111190   

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
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM111190 (US10112950, Example 42 | US10556908, Example 42 | ...) Show SMILES CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r| Show InChI InChI=1S/C28H30N6O/c1-19-4-8-23(9-5-19)26-25(22-10-6-20(14-29)7-11-22)32-28(35-18-21-12-13-30-15-21)27-31-24(16-33(2)3)17-34(26)27/h4-11,17,21,30H,12-13,15-16,18H2,1-3H3/t21-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	7.5	25
Incyte Corporation US Patent					Assay Description 10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 mM NaCl, 5 mM DTT) were preincubated ...				US Patent US9695180 (2017) BindingDB Entry DOI: 10.7270/Q2WQ01ZW
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM111190 (US10112950, Example 42 | US10556908, Example 42 | ...) Show SMILES CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r| Show InChI InChI=1S/C28H30N6O/c1-19-4-8-23(9-5-19)26-25(22-10-6-20(14-29)7-11-22)32-28(35-18-21-12-13-30-15-21)27-31-24(16-33(2)3)17-34(26)27/h4-11,17,21,30H,12-13,15-16,18H2,1-3H3/t21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation US Patent					Assay Description LANCE LSD1/KDM1A demethylase assay 10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 ...				US Patent US10556908 (2020) BindingDB Entry DOI: 10.7270/Q2FT8PDM
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM111190 (US10112950, Example 42 | US10556908, Example 42 | ...) Show SMILES CN(C)Cc1cn2c(-c3ccc(C)cc3)c(nc(OC[C@@H]3CCNC3)c2n1)-c1ccc(cc1)C#N |r| Show InChI InChI=1S/C28H30N6O/c1-19-4-8-23(9-5-19)26-25(22-10-6-20(14-29)7-11-22)32-28(35-18-21-12-13-30-15-21)27-31-24(16-33(2)3)17-34(26)27/h4-11,17,21,30H,12-13,15-16,18H2,1-3H3/t21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	7.5	n/a
Incyte Corporation US Patent					Assay Description LANCE LSD1/KDM1A demethylase assay-10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 ...				US Patent US10112950 (2018) BindingDB Entry DOI: 10.7270/Q2HT2RCB
					More data for this Ligand-Target Pair