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SMILES: CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)COc3c2)n2cncc12

InChI Key: InChIKey=OJDRTMPNECBXRB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 441877   
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 1A


(Homo sapiens (Human))		BDBM441877
PNG
(4-[8-[4-(dimethylamino)piperidin-1-yl]-5-(4-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)COc3c2)n2cncc12
Show InChI InChI=1S/C29H29N7O2/c1-33(2)22-10-12-35(13-11-22)29-24-16-31-18-36(24)28(27(32-29)20-6-4-19(15-30)5-7-20)21-8-9-23-25(14-21)38-17-26(37)34(23)3/h4-9,14,16,18,22H,10-13,17H2,1-3H3
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US Patent
n/an/a<50n/an/an/an/an/an/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 US10640503 (2020)

More data for this
Ligand-Target Pair