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Patent code US9944647

Compile Data Set for Download or QSAR
Found 138 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
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 1A


(Homo sapiens (Human))
BDBM388888
PNG
((3S)-1-[4-(7-(4-cyanophenyl)-5-{[(3R)-1-methylpipe...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CC[C@@H](C4)C#N)cc3)c3nccn23)C1
Show InChI InChI=1S/C32H33N7O/c1-37-14-2-3-26(19-37)22-40-32-36-30(28-10-4-23(17-33)5-11-28)29(31-35-13-16-39(31)32)27-8-6-24(7-9-27)20-38-15-12-25(18-34)21-38/h4-11,13,16,25-26H,2-3,12,14-15,19-22H2,1H3/t25-,26-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388894
PNG
(4-[5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-(1-m...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ccc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H27N7O/c1-33-11-3-4-20(17-33)18-36-28-32-25(21-7-5-19(15-29)6-8-21)24(27-30-10-13-35(27)28)23-14-22-9-12-34(2)26(22)31-16-23/h5-10,12-14,16,20H,3-4,11,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388908
PNG
(4-[5-{[(3R)-1-ethylpiperidin-3-yl]methoxy}-8-(1-me...)
Show SMILES CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H28N8O/c1-3-35-11-4-5-20(17-35)18-37-28-33-25(21-8-6-19(14-29)7-9-21)24(27-30-10-12-36(27)28)22-13-23-16-32-34(2)26(23)31-15-22/h6-10,12-13,15-16,20H,3-5,11,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388938
PNG
(4-(8-(5-fluoro-6-methoxypyridin-3-yl)-5-{[(3R)-1-(...)
Show SMILES COc1ncc(cc1F)-c1c(nc(OC[C@@H]2CCCN(CCO)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H27FN6O3/c1-36-26-22(28)13-21(15-31-26)23-24(20-6-4-18(14-29)5-7-20)32-27(34-10-8-30-25(23)34)37-17-19-3-2-9-33(16-19)11-12-35/h4-8,10,13,15,19,35H,2-3,9,11-12,16-17H2,1H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388954
PNG
(4-(8-(6-methoxy-5-methylpyridin-3-yl)-5-{[(3R)-1-m...)
Show SMILES COc1ncc(cc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H28N6O2/c1-18-13-22(15-30-26(18)34-3)23-24(21-8-6-19(14-28)7-9-21)31-27(33-12-10-29-25(23)33)35-17-20-5-4-11-32(2)16-20/h6-10,12-13,15,20H,4-5,11,16-17H2,1-3H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388968
PNG
(4-{8-[6-(dimethylamino)-5- fluoropyridin-3-yl]-5-[...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(N(C)C)c(F)c2)c2nccn12
Show InChI InChI=1S/C27H29FN8/c1-33(2)21-9-12-35(13-10-21)27-32-24(19-7-5-18(16-29)6-8-19)23(26-30-11-14-36(26)27)20-15-22(28)25(31-17-20)34(3)4/h5-8,11,14-15,17,21H,9-10,12-13H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388979
PNG
(4-(8-[3-(1-hydroxyethyl)-4- methylphenyl]-5-{[(3R)...)
Show SMILES CC(O)c1cc(ccc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H31N5O2/c1-19-6-9-24(15-25(19)20(2)35)26-27(23-10-7-21(16-30)8-11-23)32-29(34-14-12-31-28(26)34)36-18-22-5-4-13-33(3)17-22/h6-12,14-15,20,22,35H,4-5,13,17-18H2,1-3H3/t20?,22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388983
PNG
(4-(8-[2-fluoro-4-(morpholin-4- ylmethyl)phenyl]-5-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)cc3F)c3nccn23)C1
Show InChI InChI=1S/C31H33FN6O2/c1-36-11-2-3-24(19-36)21-40-31-35-29(25-7-4-22(18-33)5-8-25)28(30-34-10-12-38(30)31)26-9-6-23(17-27(26)32)20-37-13-15-39-16-14-37/h4-10,12,17,24H,2-3,11,13-16,19-21H2,1H3/t24-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388994
PNG
(4-{8-(5-chloro-6-methylpyridin-3- yl)-5-[4-(dimeth...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(Cl)c2)c2nccn12
Show InChI InChI=1S/C26H26ClN7/c1-17-22(27)14-20(16-30-17)23-24(19-6-4-18(15-28)5-7-19)31-26(34-13-10-29-25(23)34)33-11-8-21(9-12-33)32(2)3/h4-7,10,13-14,16,21H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389004
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(5-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(F)c2)c2nccn12
Show InChI InChI=1S/C26H26FN7/c1-17-22(27)14-20(16-30-17)23-24(19-6-4-18(15-28)5-7-19)31-26(34-13-10-29-25(23)34)33-11-8-21(9-12-33)32(2)3/h4-7,10,13-14,16,21H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388883
PNG
(4-(8-(1-methyl-1H-indazol-5-yl)-5-{[(3R)-1-methylp...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H27N7O/c1-33-12-3-4-20(17-33)18-36-28-32-26(21-7-5-19(15-29)6-8-21)25(27-30-11-13-35(27)28)22-9-10-24-23(14-22)16-31-34(24)2/h5-11,13-14,16,20H,3-4,12,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388884
PNG
(4-(8-{4-[(4-methylpiperazin-1-yl)methyl]phenyl}-5-...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2c(nc(OC[C@@H]3CCCN(C)C3)n3ccnc23)-c2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C32H37N7O/c1-36-16-18-38(19-17-36)22-25-7-9-27(10-8-25)29-30(28-11-5-24(20-33)6-12-28)35-32(39-15-13-34-31(29)39)40-23-26-4-3-14-37(2)21-26/h5-13,15,26H,3-4,14,16-19,21-23H2,1-2H3/t26-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388915
PNG
(4-(8-[4-(hydroxymethyl)phenyl]-5-{[(3R)-1-methylpi...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)cc3)c3nccn23)C1
Show InChI InChI=1S/C27H27N5O2/c1-31-13-2-3-21(16-31)18-34-27-30-25(23-10-4-19(15-28)5-11-23)24(26-29-12-14-32(26)27)22-8-6-20(17-33)7-9-22/h4-12,14,21,33H,2-3,13,16-18H2,1H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388916
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(1-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ncc3c2)c2nccn12
Show InChI InChI=1S/C27H27N9/c1-33(2)22-8-11-35(12-9-22)27-32-24(19-6-4-18(15-28)5-7-19)23(26-29-10-13-36(26)27)20-14-21-17-31-34(3)25(21)30-16-20/h4-7,10,13-14,16-17,22H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388917
PNG
(4-[5-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-8-(1-...)
Show SMILES CN(C)[C@@H]1CCN(C1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ncc3c2)c2nccn12
Show InChI InChI=1S/C26H25N9/c1-32(2)21-8-10-34(16-21)26-31-23(18-6-4-17(13-27)5-7-18)22(25-28-9-11-35(25)26)19-12-20-15-30-33(3)24(20)29-14-19/h4-7,9,11-12,14-15,21H,8,10,16H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388939
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(4-fluoro...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(F)c3n(C)c(=O)oc3c2)c2nccn12
Show InChI InChI=1S/C28H26FN7O2/c1-33(2)20-8-11-35(12-9-20)27-32-24(18-6-4-17(16-30)5-7-18)23(26-31-10-13-36(26)27)19-14-21(29)25-22(15-19)38-28(37)34(25)3/h4-7,10,13-15,20H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388940
PNG
(4-(8-(4-fluoro-3-methyl-2-oxo-2,3-dihydro-1,3-benz...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(F)c4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H25FN6O3/c1-33-10-3-4-18(15-33)16-37-27-32-24(19-7-5-17(14-30)6-8-19)23(26-31-9-11-35(26)27)20-12-21(29)25-22(13-20)38-28(36)34(25)2/h5-9,11-13,18H,3-4,10,15-16H2,1-2H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388955
PNG
(5-(7-(4-cyanophenyl)-5-{[(3R)-1-methylpiperidin-3-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(c3)C#N)c3nccn23)C1
Show InChI InChI=1S/C27H25N7O/c1-18-22(14-29)12-23(15-31-18)24-25(21-7-5-19(13-28)6-8-21)32-27(34-11-9-30-26(24)34)35-17-20-4-3-10-33(2)16-20/h5-9,11-12,15,20H,3-4,10,16-17H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388973
PNG
(US9944647, Example 87 | methyl [4-(7-(4-cyanopheny...)
Show SMILES COC(=O)N(C)Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C30H32N6O3/c1-34-15-4-5-23(18-34)20-39-29-33-27(25-12-6-21(17-31)7-13-25)26(28-32-14-16-36(28)29)24-10-8-22(9-11-24)19-35(2)30(37)38-3/h6-14,16,23H,4-5,15,18-20H2,1-3H3/t23-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388992
PNG
(4-(8-[3-chloro-4- (hydroxymethyl)phenyl]-5-{[(3R)-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(Cl)c3)c3nccn23)C1
Show InChI InChI=1S/C27H26ClN5O2/c1-32-11-2-3-19(15-32)17-35-27-31-25(20-6-4-18(14-29)5-7-20)24(26-30-10-12-33(26)27)21-8-9-22(16-34)23(28)13-21/h4-10,12-13,19,34H,2-3,11,15-17H2,1H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388996
PNG
(5-{7-(4-cyanophenyl)-5-[4- (dimethylamino)piperidi...)
Show SMILES COc1ncc(cc1C#N)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H26N8O/c1-33(2)22-8-11-34(12-9-22)27-32-24(19-6-4-18(15-28)5-7-19)23(25-30-10-13-35(25)27)21-14-20(16-29)26(36-3)31-17-21/h4-7,10,13-14,17,22H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389011
PNG
(4-{8-(1,3-benzothiazol-5-yl)-5-[4- (dimethylamino)...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3scnc3c2)c2nccn12
Show InChI InChI=1S/C27H25N7S/c1-32(2)21-9-12-33(13-10-21)27-31-25(19-5-3-18(16-28)4-6-19)24(26-29-11-14-34(26)27)20-7-8-23-22(15-20)30-17-35-23/h3-8,11,14-15,17,21H,9-10,12-13H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388882
PNG
(4-(8-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H26N6O3/c1-32-12-3-4-19(16-32)17-36-27-31-25(20-7-5-18(15-29)6-8-20)24(26-30-11-13-34(26)27)21-9-10-22-23(14-21)37-28(35)33(22)2/h5-11,13-14,19H,3-4,12,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388911
PNG
(4-(8-[3,5-difluoro-4-(hydroxymethyl)phenyl]-5-{[(3...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(F)c(CO)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C27H25F2N5O2/c1-33-9-2-3-18(14-33)16-36-27-32-25(19-6-4-17(13-30)5-7-19)24(26-31-8-10-34(26)27)20-11-22(28)21(15-35)23(29)12-20/h4-8,10-12,18,35H,2-3,9,14-16H2,1H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388925
PNG
(4-(8-(5-fluoro-3-methyl-2-oxo-2,3-dihydro-1,3-benz...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc4oc(=O)n(C)c4cc3F)c3nccn23)C1
Show InChI InChI=1S/C28H25FN6O3/c1-33-10-3-4-18(15-33)16-37-27-32-25(19-7-5-17(14-30)6-8-19)24(26-31-9-11-35(26)27)20-12-23-22(13-21(20)29)34(2)28(36)38-23/h5-9,11-13,18H,3-4,10,15-16H2,1-2H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388926
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(1-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)ncc3c2)c2nccn12
Show InChI InChI=1S/C28H28N8/c1-33(2)23-10-13-35(14-11-23)28-32-26(20-6-4-19(17-29)5-7-20)25(27-30-12-15-36(27)28)21-8-9-24-22(16-21)18-31-34(24)3/h4-9,12,15-16,18,23H,10-11,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388927
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(3-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)oc3c2)c2nccn12
Show InChI InChI=1S/C28H27N7O2/c1-32(2)21-10-13-34(14-11-21)27-31-25(19-6-4-18(17-29)5-7-19)24(26-30-12-15-35(26)27)20-8-9-22-23(16-20)37-28(36)33(22)3/h4-9,12,15-16,21H,10-11,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388946
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(1,2-dime...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(C)nc3c2)c2nccn12
Show InChI InChI=1S/C29H30N8/c1-19-32-24-17-22(9-10-25(24)35(19)4)26-27(21-7-5-20(18-30)6-8-21)33-29(37-16-13-31-28(26)37)36-14-11-23(12-15-36)34(2)3/h5-10,13,16-17,23H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388972
PNG
(N-[4-(7-(4-cyanophenyl)-5-{[(3R)-1- methylpiperidi...)
Show SMILES CN(C)C(=O)N(C)Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C31H35N7O2/c1-35(2)31(39)37(4)20-23-9-11-25(12-10-23)27-28(26-13-7-22(18-32)8-14-26)34-30(38-17-15-33-29(27)38)40-21-24-6-5-16-36(3)19-24/h7-15,17,24H,5-6,16,19-21H2,1-4H3/t24-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388974
PNG
(4-(8-(5-chloro-6-methoxypyridin-3- yl)-5-{[(3R)-1-...)
Show SMILES COc1ncc(cc1Cl)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H25ClN6O2/c1-32-10-3-4-18(15-32)16-35-26-31-23(19-7-5-17(13-28)6-8-19)22(24-29-9-11-33(24)26)20-12-21(27)25(34-2)30-14-20/h5-9,11-12,14,18H,3-4,10,15-16H2,1-2H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389005
PNG
(US9944647, Example 114 | methyl (4-{7-(4-cyanophen...)
Show SMILES COC(=O)N(C)c1ccc(cc1)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H31N7O2/c1-33(2)23-13-16-35(17-14-23)28-32-26(22-7-5-20(19-30)6-8-22)25(27-31-15-18-36(27)28)21-9-11-24(12-10-21)34(3)29(37)38-4/h5-12,15,18,23H,13-14,16-17H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389006
PNG
(N-(5-{7-(4-cyanophenyl)-5-[4- (dimethylamino)piper...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(nc2)N(C)S(C)(=O)=O)c2nccn12
Show InChI InChI=1S/C27H30N8O2S/c1-32(2)22-11-14-34(15-12-22)27-31-25(20-7-5-19(17-28)6-8-20)24(26-29-13-16-35(26)27)21-9-10-23(30-18-21)33(3)38(4,36)37/h5-10,13,16,18,22H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389016
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(1-methy...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)ccc3c2)c2nccn12
Show InChI InChI=1S/C28H28N8/c1-33(2)23-9-13-35(14-10-23)28-32-25(20-6-4-19(17-29)5-7-20)24(27-30-11-15-36(27)28)22-16-21-8-12-34(3)26(21)31-18-22/h4-8,11-12,15-16,18,23H,9-10,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389021
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(1-methy...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)CCc3c2)c2nccn12
Show InChI InChI=1S/C30H31N7O/c1-34(2)24-12-15-36(16-13-24)30-33-28(21-6-4-20(19-31)5-7-21)27(29-32-14-17-37(29)30)23-8-10-25-22(18-23)9-11-26(38)35(25)3/h4-8,10,14,17-18,24H,9,11-13,15-16H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388880
PNG
(4-[5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-(6-p...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3)c3nccn23)C1
Show InChI InChI=1S/C29H31N7O/c1-34-13-4-5-22(19-34)20-37-29-33-27(23-8-6-21(17-30)7-9-23)26(28-31-12-16-36(28)29)24-10-11-25(32-18-24)35-14-2-3-15-35/h6-12,16,18,22H,2-5,13-15,19-20H2,1H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388892
PNG
(4-(8-(1-methyl-1H-benzimidazol-5-yl)-5-{[(3R)-1-me...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)cnc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H27N7O/c1-33-12-3-4-20(16-33)17-36-28-32-26(21-7-5-19(15-29)6-8-21)25(27-30-11-13-35(27)28)22-9-10-24-23(14-22)31-18-34(24)2/h5-11,13-14,18,20H,3-4,12,16-17H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388907
PNG
(4-[5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-(1-m...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H26N8O/c1-33-10-3-4-19(16-33)17-36-27-32-24(20-7-5-18(13-28)6-8-20)23(26-29-9-11-35(26)27)21-12-22-15-31-34(2)25(22)30-14-21/h5-9,11-12,14-15,19H,3-4,10,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388930
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(5-fluoro...)
Show SMILES COc1ncc(cc1F)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H26FN7O/c1-32(2)20-8-11-33(12-9-20)26-31-23(18-6-4-17(15-28)5-7-18)22(24-29-10-13-34(24)26)19-14-21(27)25(35-3)30-16-19/h4-7,10,13-14,16,20H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388947
PNG
(4-(8-[2-(difluoromethyl)-1-methyl-1H-benzimidazol-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(nc4c3)C(F)F)c3nccn23)C1
Show InChI InChI=1S/C29H27F2N7O/c1-36-12-3-4-19(16-36)17-39-29-35-25(20-7-5-18(15-32)6-8-20)24(27-33-11-13-38(27)29)21-9-10-23-22(14-21)34-28(26(30)31)37(23)2/h5-11,13-14,19,26H,3-4,12,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388963
PNG
(4-(8-(1-mcthyl-2.3-dihydro-1H- pyrrolo[2,3-b]pyrid...)
Show SMILES CN1CCc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N7O/c1-33-11-3-4-20(17-33)18-36-28-32-25(21-7-5-19(15-29)6-8-21)24(27-30-10-13-35(27)28)23-14-22-9-12-34(2)26(22)31-16-23/h5-8,10,13-14,16,20H,3-4,9,11-12,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389000
PNG
(4-{5-{[(3R)-1-ethylpiperidin-3- yl]methoxy}-8-[3-f...)
Show SMILES CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C29H30FN5O2/c1-3-34-11-4-5-21(16-34)18-37-29-33-27(22-8-6-20(15-31)7-9-22)26(28-32-10-12-35(28)29)23-13-19(2)24(17-36)25(30)14-23/h6-10,12-14,21,36H,3-5,11,16-18H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388653
PNG
(4-(8-(4-methylphenyl)-5-{[(3R)-1-methylpiperidin-3...)
Show SMILES CN1CCCC(COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)c3nccn23)C1
Show InChI InChI=1S/C27H27N5O/c1-19-5-9-22(10-6-19)24-25(23-11-7-20(16-28)8-12-23)30-27(32-15-13-29-26(24)32)33-18-21-4-3-14-31(2)17-21/h5-13,15,21H,3-4,14,17-18H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388879
PNG
(4-(8-[6-(dimethylamino)pyridin-3-yl]-5-{[(3R)-1-me...)
Show SMILES CN(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H29N7O/c1-32(2)23-11-10-22(16-30-23)24-25(21-8-6-19(15-28)7-9-21)31-27(34-14-12-29-26(24)34)35-18-20-5-4-13-33(3)17-20/h6-12,14,16,20H,4-5,13,17-18H2,1-3H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388895
PNG
(5-(7-(4-cyanophenyl)-5-{[(3R)-1-methylpiperidin-3-...)
Show SMILES CN(C)C(=O)C1Cc2cc(ccc2O1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C31H32N6O3/c1-35(2)30(38)26-16-24-15-23(10-11-25(24)40-26)27-28(22-8-6-20(17-32)7-9-22)34-31(37-14-12-33-29(27)37)39-19-21-5-4-13-36(3)18-21/h6-12,14-15,21,26H,4-5,13,16,18-19H2,1-3H3/t21-,26?/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388910
PNG
(4-(8-[3-fluoro-4-(hydroxymethyl)phenyl]-5-{[(3R)-1...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C27H26FN5O2/c1-32-11-2-3-19(15-32)17-35-27-31-25(20-6-4-18(14-29)5-7-20)24(26-30-10-12-33(26)27)21-8-9-22(16-34)23(28)13-21/h4-10,12-13,19,34H,2-3,11,15-17H2,1H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388913
PNG
(4-[5-{[(3R)-1-(2-hydroxyethyl)piperidin-3-yl]metho...)
Show SMILES Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CCO)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H28N8O2/c1-34-26-23(16-32-34)13-22(15-31-26)24-25(21-6-4-19(14-29)5-7-21)33-28(36-10-8-30-27(24)36)38-18-20-3-2-9-35(17-20)11-12-37/h4-8,10,13,15-16,20,37H,2-3,9,11-12,17-18H2,1H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388914
PNG
(4-(8-[4-(hydroxymethyl)-3-methylphenyl]-5-{[(3R)-1...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CO)c(C)c3)c3nccn23)C1
Show InChI InChI=1S/C28H29N5O2/c1-19-14-23(9-10-24(19)17-34)25-26(22-7-5-20(15-29)6-8-22)31-28(33-13-11-30-27(25)33)35-18-21-4-3-12-32(2)16-21/h5-11,13-14,21,34H,3-4,12,16-18H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388920
PNG
(US9944647, Example 40 | methyl[4-(7-(4-cyanophenyl...)
Show SMILES COC(=O)N(C)Cc1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C30H31FN6O3/c1-35-13-4-5-21(17-35)19-40-29-34-27(22-8-6-20(16-32)7-9-22)26(28-33-12-14-37(28)29)23-10-11-24(25(31)15-23)18-36(2)30(38)39-3/h6-12,14-15,21H,4-5,13,17-19H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388923
PNG
(4-(8-(3-methyl-2-oxo-3,4-dihydro-2H-1,3-benzoxazin...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CN(C)C(=O)Oc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H28N6O3/c1-33-12-3-4-20(16-33)18-37-28-32-26(21-7-5-19(15-30)6-8-21)25(27-31-11-13-35(27)28)22-9-10-23-17-34(2)29(36)38-24(23)14-22/h5-11,13-14,20H,3-4,12,16-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388932
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(4-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)COc3c2)c2nccn12
Show InChI InChI=1S/C29H29N7O2/c1-33(2)22-10-13-35(14-11-22)29-32-27(20-6-4-19(17-30)5-7-20)26(28-31-12-15-36(28)29)21-8-9-23-24(16-21)38-18-25(37)34(23)3/h4-9,12,15-16,22H,10-11,13-14,18H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388935
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(5-fluoro...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc3oc(=O)n(C)c3cc2F)c2nccn12
Show InChI InChI=1S/C28H26FN7O2/c1-33(2)19-8-11-35(12-9-19)27-32-25(18-6-4-17(16-30)5-7-18)24(26-31-10-13-36(26)27)20-14-23-22(15-21(20)29)34(3)28(37)38-23/h4-7,10,13-15,19H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388944
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(1-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3N(C)C(=O)Cc3c2)c2nccn12
Show InChI InChI=1S/C29H29N7O/c1-33(2)23-10-13-35(14-11-23)29-32-27(20-6-4-19(18-30)5-7-20)26(28-31-12-15-36(28)29)21-8-9-24-22(16-21)17-25(37)34(24)3/h4-9,12,15-16,23H,10-11,13-14,17H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388957
PNG
(4-(8-[3-(hydroxymethyl)-4-methylphenyl]-5-{[(3R)-1...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CO)c3)c3nccn23)C1
Show InChI InChI=1S/C28H29N5O2/c1-19-5-8-23(14-24(19)17-34)25-26(22-9-6-20(15-29)7-10-22)31-28(33-13-11-30-27(25)33)35-18-21-4-3-12-32(2)16-21/h5-11,13-14,21,34H,3-4,12,16-18H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388966
PNG
(4-(8-[3-fluoro-4-(morpholin-4- ylmethyl)phenyl]-5-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C31H33FN6O2/c1-36-11-2-3-23(19-36)21-40-31-35-29(24-6-4-22(18-33)5-7-24)28(30-34-10-12-38(30)31)25-8-9-26(27(32)17-25)20-37-13-15-39-16-14-37/h4-10,12,17,23H,2-3,11,13-16,19-21H2,1H3/t23-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388977
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-[4-(hydr...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(CO)c(C)c2)c2nccn12
Show InChI InChI=1S/C28H30N6O/c1-19-16-22(8-9-23(19)18-35)25-26(21-6-4-20(17-29)5-7-21)31-28(34-15-12-30-27(25)34)33-13-10-24(11-14-33)32(2)3/h4-9,12,15-16,24,35H,10-11,13-14,18H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388980
PNG
(4-(8-[4-(methoxymethyl)phenyl]-5- {[(3R)-1-methylp...)
Show SMILES COCc1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N5O2/c1-32-14-3-4-22(17-32)19-35-28-31-26(24-11-5-20(16-29)6-12-24)25(27-30-13-15-33(27)28)23-9-7-21(8-10-23)18-34-2/h5-13,15,22H,3-4,14,17-19H2,1-2H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388997
PNG
(US9944647, Example 106 | methyl [5-(7-(4-cyanophen...)
Show SMILES COC(=O)N(C)c1cc(ccc1C)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C30H32N6O3/c1-20-7-10-24(16-25(20)35(3)30(37)38-4)26-27(23-11-8-21(17-31)9-12-23)33-29(36-15-13-32-28(26)36)39-19-22-6-5-14-34(2)18-22/h7-13,15-16,22H,5-6,14,18-19H2,1-4H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389001
PNG
(4-{5-[(3R)-3- (dimethylamino)pyrrolidin-1-yl]-8- [...)
Show SMILES CN(C)[C@@H]1CCN(C1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(C)c(CO)c(F)c2)c2nccn12
Show InChI InChI=1S/C27H27FN6O/c1-17-12-20(13-23(28)22(17)16-35)24-25(19-6-4-18(14-29)5-7-19)31-27(34-11-9-30-26(24)34)33-10-8-21(15-33)32(2)3/h4-7,9,11-13,21,35H,8,10,15-16H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389002
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-[2-(hydr...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)cc2CO)c2nccn12
Show InChI InChI=1S/C28H30N6O/c1-19-4-9-24(22(16-19)18-35)25-26(21-7-5-20(17-29)6-8-21)31-28(34-15-12-30-27(25)34)33-13-10-23(11-14-33)32(2)3/h4-9,12,15-16,23,35H,10-11,13-14,18H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389028
PNG
(4-[5-({(3R)-1-[(2S)-2- hydroxypropyl]piperidin-3- ...)
Show SMILES C[C@H](O)CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H30N8O2/c1-19(38)16-36-10-3-4-21(17-36)18-39-29-34-26(22-7-5-20(13-30)6-8-22)25(28-31-9-11-37(28)29)23-12-24-15-33-35(2)27(24)32-14-23/h5-9,11-12,14-15,19,21,38H,3-4,10,16-18H2,1-2H3/t19-,21+/m0/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388899
PNG
(4-(8-(4-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]ox...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)CCOc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H27N7O2/c1-32-9-7-19(16-32)17-36-27-31-24(20-5-3-18(14-28)4-6-20)23(26-29-8-10-34(26)27)21-13-22-25(30-15-21)33(2)11-12-35-22/h3-6,8,10,13,15,19H,7,9,11-12,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388918
PNG
(4-[5-(7-methyl-2,7-diazaspiro[4.4]non-2-yl)-8-(1-m...)
Show SMILES CN1CCC2(CCN(C2)c2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H27N9/c1-34-10-7-28(17-34)8-11-36(18-28)27-33-24(20-5-3-19(14-29)4-6-20)23(26-30-9-12-37(26)27)21-13-22-16-32-35(2)25(22)31-15-21/h3-6,9,12-13,15-16H,7-8,10-11,17-18H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388936
PNG
(4-[5-{1[(3R)-1-ethylpiperidin-3-yl]methoxy}-8-(3-m...)
Show SMILES CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H28N6O3/c1-3-34-13-4-5-20(17-34)18-37-28-32-26(21-8-6-19(16-30)7-9-21)25(27-31-12-14-35(27)28)22-10-11-23-24(15-22)38-29(36)33(23)2/h6-12,14-15,20H,3-5,13,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388948
PNG
(4-(8-(1,2-dimethyl-1H-benzimidazol-5-yl)-5-{[(3R)-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(C)nc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H29N7O/c1-19-32-24-15-23(10-11-25(24)35(19)3)26-27(22-8-6-20(16-30)7-9-22)33-29(36-14-12-31-28(26)36)37-18-21-5-4-13-34(2)17-21/h6-12,14-15,21H,4-5,13,17-18H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388953
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(5,6-dime...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(C)c2)c2nccn12
Show InChI InChI=1S/C27H29N7/c1-18-15-22(17-30-19(18)2)24-25(21-7-5-20(16-28)6-8-21)31-27(34-14-11-29-26(24)34)33-12-9-23(10-13-33)32(3)4/h5-8,11,14-15,17,23H,9-10,12-13H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388958
PNG
(4-(8-[2-(hydroxymethyl)-4-methylphenyl]-5-{[(3R)-1...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3CO)c3nccn23)C1
Show InChI InChI=1S/C28H29N5O2/c1-19-5-10-24(23(14-19)17-34)25-26(22-8-6-20(15-29)7-9-22)31-28(33-13-11-30-27(25)33)35-18-21-4-3-12-32(2)16-21/h5-11,13-14,21,34H,3-4,12,16-18H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388985
PNG
(N-(4-{7-(4-cyanophenyl)-5-[4- (dimethylamino)piper...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(CN(C)C(=O)N(C)C)c(F)c2)c2nccn12
Show InChI InChI=1S/C31H35FN8O/c1-36(2)25-12-15-39(16-13-25)30-35-28(22-8-6-21(19-33)7-9-22)27(29-34-14-17-40(29)30)23-10-11-24(26(32)18-23)20-38(5)31(41)37(3)4/h6-11,14,17-18,25H,12-13,15-16,20H2,1-5H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388991
PNG
(4-{5-[(3R)-3- (dimethylamino)pyrrolidin-1-yl]-8- [...)
Show SMILES CN(C)[C@@H]1CCN(C1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)c(CO)c2)c2nccn12
Show InChI InChI=1S/C27H28N6O/c1-18-4-7-21(14-22(18)17-34)24-25(20-8-5-19(15-28)6-9-20)30-27(33-13-11-29-26(24)33)32-12-10-23(16-32)31(2)3/h4-9,11,13-14,23,34H,10,12,16-17H2,1-3H3/t23-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389014
PNG
(4-(8-(3-hydroxy-2,3-dihydro-1H- inden-5-yl)-5-{[(3...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CCC(O)c4c3)c3nccn23)C1
Show InChI InChI=1S/C29H29N5O2/c1-33-13-2-3-20(17-33)18-36-29-32-27(22-6-4-19(16-30)5-7-22)26(28-31-12-14-34(28)29)23-9-8-21-10-11-25(35)24(21)15-23/h4-9,12,14-15,20,25,35H,2-3,10-11,13,17-18H2,1H3/t20-,25?/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389019
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(7-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(F)c3n(C)c(=O)n(C)c3c2)c2nccn12
Show InChI InChI=1S/C29H29FN8O/c1-34(2)21-9-12-37(13-10-21)28-33-25(19-7-5-18(17-31)6-8-19)24(27-32-11-14-38(27)28)20-15-22(30)26-23(16-20)35(3)29(39)36(26)4/h5-8,11,14-16,21H,9-10,12-13H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389025
PNG
(4-[5-({(3R)-1-[(2S)-2- hydroxypropyl]piperidin-3- ...)
Show SMILES C[C@H](O)CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C30H30N6O4/c1-19(37)16-35-12-3-4-21(17-35)18-39-29-33-27(22-7-5-20(15-31)6-8-22)26(28-32-11-13-36(28)29)23-9-10-24-25(14-23)40-30(38)34(24)2/h5-11,13-14,19,21,37H,3-4,12,16-18H2,1-2H3/t19-,21+/m0/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388878
PNG
(4-(8-(6-methoxypyridin-3-yl)-5-{[(3R)-1-methylpipe...)
Show SMILES COc1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H26N6O2/c1-31-12-3-4-19(16-31)17-34-26-30-24(20-7-5-18(14-27)6-8-20)23(25-28-11-13-32(25)26)21-9-10-22(33-2)29-15-21/h5-11,13,15,19H,3-4,12,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388885
PNG
(4-(8-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phe...)
Show SMILES CN1CCN(CC1)C(=O)Cc1ccc(cc1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C33H37N7O2/c1-37-16-18-39(19-17-37)29(41)20-24-5-9-27(10-6-24)30-31(28-11-7-25(21-34)8-12-28)36-33(40-15-13-35-32(30)40)42-23-26-4-3-14-38(2)22-26/h5-13,15,26H,3-4,14,16-20,22-23H2,1-2H3/t26-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388889
PNG
(4-(8-(4-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]ox...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)CCOc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H29N7O2/c1-33-10-3-4-20(17-33)18-37-28-32-25(21-7-5-19(15-29)6-8-21)24(27-30-9-11-35(27)28)22-14-23-26(31-16-22)34(2)12-13-36-23/h5-9,11,14,16,20H,3-4,10,12-13,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388906
PNG
(4-(8-(1-methyl-1H-indazol-5-yl)-5-{[(3R)-1-methylp...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H25N7O/c1-32-11-9-19(16-32)17-35-27-31-25(20-5-3-18(14-28)4-6-20)24(26-29-10-12-34(26)27)21-7-8-23-22(13-21)15-30-33(23)2/h3-8,10,12-13,15,19H,9,11,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388909
PNG
(4-(8-[3-fluoro-4-(hydroxymethyl)-5-methylphenyl]-5...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cc(C)c(CO)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C28H28FN5O2/c1-18-12-22(13-24(29)23(18)16-35)25-26(21-7-5-19(14-30)6-8-21)32-28(34-11-9-31-27(25)34)36-17-20-4-3-10-33(2)15-20/h5-9,11-13,20,35H,3-4,10,15-17H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388937
PNG
(4-[5-{[(3R)-1-(2-hydroxyethyl)piperidin-3-yl]metho...)
Show SMILES COc1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(CCO)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H28N6O3/c1-35-23-9-8-22(16-30-23)24-25(21-6-4-19(15-28)5-7-21)31-27(33-12-10-29-26(24)33)36-18-20-3-2-11-32(17-20)13-14-34/h4-10,12,16,20,34H,2-3,11,13-14,17-18H2,1H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388975
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-[3-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(C)c(CO)c(F)c2)c2nccn12
Show InChI InChI=1S/C28H29FN6O/c1-18-14-21(15-24(29)23(18)17-36)25-26(20-6-4-19(16-30)5-7-20)32-28(35-13-10-31-27(25)35)34-11-8-22(9-12-34)33(2)3/h4-7,10,13-15,22,36H,8-9,11-12,17H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388978
PNG
(4-(8-(5-chloro-6-methylpyridin-3- yl)-5-{[(3R)-1-m...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(Cl)c3)c3nccn23)C1
Show InChI InChI=1S/C26H25ClN6O/c1-17-22(27)12-21(14-30-17)23-24(20-7-5-18(13-28)6-8-20)31-26(33-11-9-29-25(23)33)34-16-19-4-3-10-32(2)15-19/h5-9,11-12,14,19H,3-4,10,15-16H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388984
PNG
(5-(7-(4-cyanophenyl)-5-{[(3R)-1- methylpiperidin-3...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(c3)C#N)c3nccn23)C1
Show InChI InChI=1S/C28H26N6O/c1-19-5-8-23(14-24(19)16-30)25-26(22-9-6-20(15-29)7-10-22)32-28(34-13-11-31-27(25)34)35-18-21-4-3-12-33(2)17-21/h5-11,13-14,21H,3-4,12,17-18H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389015
PNG
(4-(8-(2-hydroxy-2,3-dihydro-1H- inden-5-yl)-5-{[(3...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CC(O)Cc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H29N5O2/c1-33-11-2-3-20(17-33)18-36-29-32-27(21-6-4-19(16-30)5-7-21)26(28-31-10-12-34(28)29)23-9-8-22-14-25(35)15-24(22)13-23/h4-10,12-13,20,25,35H,2-3,11,14-15,17-18H2,1H3/t20-,25?/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389018
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(4-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(=O)n(C)c3c2F)c2nccn12
Show InChI InChI=1S/C29H29FN8O/c1-34(2)20-11-14-37(15-12-20)28-33-25(19-7-5-18(17-31)6-8-19)23(27-32-13-16-38(27)28)21-9-10-22-26(24(21)30)36(4)29(39)35(22)3/h5-10,13,16,20H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388912
PNG
(4-[5-{[(3R)-1-(2-cyanoethyl)piperidin-3-yl]methoxy...)
Show SMILES Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CCC#N)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H27N9O/c1-36-27-24(17-34-36)14-23(16-33-27)25-26(22-7-5-20(15-31)6-8-22)35-29(38-13-10-32-28(25)38)39-19-21-4-2-11-37(18-21)12-3-9-30/h5-8,10,13-14,16-17,21H,2-4,11-12,18-19H2,1H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388921
PNG
(4-[5-{[(3R)-1-(2-methoxyethyl)piperidin-3-yl]metho...)
Show SMILES COCCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H30N8O2/c1-35-27-24(17-33-35)14-23(16-32-27)25-26(22-7-5-20(15-30)6-8-22)34-29(37-11-9-31-28(25)37)39-19-21-4-3-10-36(18-21)12-13-38-2/h5-9,11,14,16-17,21H,3-4,10,12-13,18-19H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388922
PNG
(4-(8-(3-amino-1-methyl-1H-indazol-5-yl)-5-{[(3R)-1...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)nc(N)c4c3)c3nccn23)C1
Show InChI InChI=1S/C28H28N8O/c1-34-12-3-4-19(16-34)17-37-28-32-25(20-7-5-18(15-29)6-8-20)24(27-31-11-13-36(27)28)21-9-10-23-22(14-21)26(30)33-35(23)2/h5-11,13-14,19H,3-4,12,16-17H2,1-2H3,(H2,30,33)/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388933
PNG
(4-{8-[2-(difluoromethyl)-1-methyl-1H-benzimidazol-...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3n(C)c(nc3c2)C(F)F)c2nccn12
Show InChI InChI=1S/C29H28F2N8/c1-36(2)21-10-13-38(14-11-21)29-35-25(19-6-4-18(17-32)5-7-19)24(27-33-12-15-39(27)29)20-8-9-23-22(16-20)34-28(26(30)31)37(23)3/h4-9,12,15-16,21,26H,10-11,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388934
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(6-methox...)
Show SMILES COc1ncc(cc1C)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H29N7O/c1-18-15-21(17-30-26(18)35-4)23-24(20-7-5-19(16-28)6-8-20)31-27(34-14-11-29-25(23)34)33-12-9-22(10-13-33)32(2)3/h5-8,11,14-15,17,22H,9-10,12-13H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388941
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(3-methyl...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc3n(C)c(=O)oc3c2)c2nccn12
Show InChI InChI=1S/C27H26N8O2/c1-32(2)20-8-11-34(12-9-20)26-31-23(18-6-4-17(15-28)5-7-18)22(25-29-10-13-35(25)26)19-14-21-24(30-16-19)33(3)27(36)37-21/h4-7,10,13-14,16,20H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388962
PNG
(7-(7-(4-cyanophcnyl)-5-{[(3R)-1- methylpiperidin-3...)
Show SMILES CN(C)C(=O)C1COc2ccc(cc2O1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C31H32N6O4/c1-35(2)30(38)26-19-39-24-11-10-23(15-25(24)41-26)27-28(22-8-6-20(16-32)7-9-22)34-31(37-14-12-33-29(27)37)40-18-21-5-4-13-36(3)17-21/h6-12,14-15,21,26H,4-5,13,17-19H2,1-3H3/t21-,26?/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388964
PNG
(4-[5-{[(3R)-1-methylpiperidin-3- yl]methoxy}-8-(8-...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4N(C)CCCc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H31N7O/c1-34-12-3-5-21(18-34)19-37-29-33-26(22-9-7-20(16-30)8-10-22)25(28-31-11-14-36(28)29)24-15-23-6-4-13-35(2)27(23)32-17-24/h7-11,14-15,17,21H,3-6,12-13,18-19H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388969
PNG
(4-[5-{[(3R)-1-(2- cyanoethyl)piperidin-3-yl]methox...)
Show SMILES Cn1c2ccc(cc2oc1=O)-c1c(nc(OC[C@@H]2CCCN(CCC#N)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C30H27N7O3/c1-35-24-10-9-23(16-25(24)40-30(35)38)26-27(22-7-5-20(17-32)6-8-22)34-29(37-15-12-33-28(26)37)39-19-21-4-2-13-36(18-21)14-3-11-31/h5-10,12,15-16,21H,2-4,13-14,18-19H2,1H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388971
PNG
(N-[4-(7-(4-cyanophenyl)-5-{[(3R)-1- methylpiperidi...)
Show SMILES CN(C)C(=O)N(C)Cc1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C31H34FN7O2/c1-36(2)31(40)38(4)19-25-12-11-24(16-26(25)32)27-28(23-9-7-21(17-33)8-10-23)35-30(39-15-13-34-29(27)39)41-20-22-6-5-14-37(3)18-22/h7-13,15-16,22H,5-6,14,18-20H2,1-4H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388976
PNG
(4-{8-[3,5-difluoro-4- (hydroxymethyl)phenyl]-5-[4-...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc(F)c(CO)c(F)c2)c2nccn12
Show InChI InChI=1S/C27H26F2N6O/c1-33(2)20-7-10-34(11-8-20)27-32-25(18-5-3-17(15-30)4-6-18)24(26-31-9-12-35(26)27)19-13-22(28)21(16-36)23(29)14-19/h3-6,9,12-14,20,36H,7-8,10-11,16H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388989
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-[3-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(CN3CCOCC3)c(F)c2)c2nccn12
Show InChI InChI=1S/C31H34FN7O/c1-36(2)26-9-12-38(13-10-26)31-35-29(23-5-3-22(20-33)4-6-23)28(30-34-11-14-39(30)31)24-7-8-25(27(32)19-24)21-37-15-17-40-18-16-37/h3-8,11,14,19,26H,9-10,12-13,15-18,21H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388990
PNG
(4-{5-{[(3R)-1-ethylpiperidin-3- yl]methoxy}-8-[3-(...)
Show SMILES CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)c(CO)c3)c3nccn23)C1
Show InChI InChI=1S/C29H31N5O2/c1-3-33-13-4-5-22(17-33)19-36-29-32-27(23-10-7-21(16-30)8-11-23)26(28-31-12-14-34(28)29)24-9-6-20(2)25(15-24)18-35/h6-12,14-15,22,35H,3-5,13,17-19H2,1-2H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388993
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-[3-(hydr...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)c(CO)c2)c2nccn12
Show InChI InChI=1S/C28H30N6O/c1-19-4-7-22(16-23(19)18-35)25-26(21-8-5-20(17-29)6-9-21)31-28(34-15-12-30-27(25)34)33-13-10-24(11-14-33)32(2)3/h4-9,12,15-16,24,35H,10-11,13-14,18H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388995
PNG
(4-{8-(5-chloro-6-methoxypyridin-3- yl)-5-[4-(dimet...)
Show SMILES COc1ncc(cc1Cl)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H26ClN7O/c1-32(2)20-8-11-33(12-9-20)26-31-23(18-6-4-17(15-28)5-7-18)22(24-29-10-13-34(24)26)19-14-21(27)25(35-3)30-16-19/h4-7,10,13-14,16,20H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389007
PNG
(US9944647, Example 116 | methyl (4-{7-(4-cyanophen...)
Show SMILES COC(=O)N(C)c1ccc(cc1F)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H30FN7O2/c1-34(2)22-11-14-36(15-12-22)28-33-26(20-7-5-19(18-31)6-8-20)25(27-32-13-16-37(27)28)21-9-10-24(23(30)17-21)35(3)29(38)39-4/h5-10,13,16-17,22H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389008
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(6-ethox...)
Show SMILES CCOc1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H29N7O/c1-4-35-23-10-9-21(18-30-23)24-25(20-7-5-19(17-28)6-8-20)31-27(34-16-13-29-26(24)34)33-14-11-22(12-15-33)32(2)3/h5-10,13,16,18,22H,4,11-12,14-15H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389012
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(3-hydro...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CCC(O)c3c2)c2nccn12
Show InChI InChI=1S/C29H30N6O/c1-33(2)23-11-14-34(15-12-23)29-32-27(21-5-3-19(18-30)4-6-21)26(28-31-13-16-35(28)29)22-8-7-20-9-10-25(36)24(20)17-22/h3-8,13,16-17,23,25,36H,9-12,14-15H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389013
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(2-hydro...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CC(O)Cc3c2)c2nccn12
Show InChI InChI=1S/C29H30N6O/c1-33(2)24-9-12-34(13-10-24)29-32-27(20-5-3-19(18-30)4-6-20)26(28-31-11-14-35(28)29)22-8-7-21-16-25(36)17-23(21)15-22/h3-8,11,14-15,24-25,36H,9-10,12-13,16-17H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389020
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(6-fluor...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cc3n(C)c(=O)n(C)c3cc2F)c2nccn12
Show InChI InChI=1S/C29H29FN8O/c1-34(2)20-9-12-37(13-10-20)28-33-26(19-7-5-18(17-31)6-8-19)25(27-32-11-14-38(27)28)21-15-23-24(16-22(21)30)36(4)29(39)35(23)3/h5-8,11,14-16,20H,9-10,12-13H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388904
PNG
(4-(8-(1-methyl-1H-benzimidazol-5-yl)-5-{[(3R)-1-me...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)cnc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H25N7O/c1-32-11-9-19(15-32)16-35-27-31-25(20-5-3-18(14-28)4-6-20)24(26-29-10-12-34(26)27)21-7-8-23-22(13-21)30-17-33(23)2/h3-8,10,12-13,17,19H,9,11,15-16H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389022
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(1-methy...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3CCC(=O)N(C)c3c2)c2nccn12
Show InChI InChI=1S/C30H31N7O/c1-34(2)24-12-15-36(16-13-24)30-33-28(22-6-4-20(19-31)5-7-22)27(29-32-14-17-37(29)30)23-9-8-21-10-11-26(38)35(3)25(21)18-23/h4-9,14,17-18,24H,10-13,15-16H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388942
PNG
(4-(8-(3-methyl-2-oxo-2,3-dihydro[1,3]oxazolo[4,5-b...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H25N7O3/c1-32-10-3-4-18(15-32)16-36-26-31-23(19-7-5-17(13-28)6-8-19)22(25-29-9-11-34(25)26)20-12-21-24(30-14-20)33(2)27(35)37-21/h5-9,11-12,14,18H,3-4,10,15-16H2,1-2H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389017
PNG
(4-{5-[4-(dimethylamino)piperidin-1- yl]-8-quinoxal...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc3nccnc3c2)c2nccn12
Show InChI InChI=1S/C28H26N8/c1-34(2)22-9-14-35(15-10-22)28-33-26(20-5-3-19(18-29)4-6-20)25(27-32-13-16-36(27)28)21-7-8-23-24(17-21)31-12-11-30-23/h3-8,11-13,16-17,22H,9-10,14-15H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389027
PNG
(4-[5-({(3R)-1-[(2R)-2- hydroxypropyl]piperidin-3- ...)
Show SMILES C[C@@H](O)CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc4n(C)ncc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H30N8O2/c1-19(38)16-36-10-3-4-21(17-36)18-39-29-34-26(22-7-5-20(13-30)6-8-22)25(28-31-9-11-37(28)29)23-12-24-15-33-35(2)27(24)32-14-23/h5-9,11-12,14-15,19,21,38H,3-4,10,16-18H2,1-2H3/t19-,21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389029
PNG
(4-[5-{[(3R)-1-(2-hydroxy-2- methylpropyl)piperidin...)
Show SMILES Cn1ncc2cc(cnc12)-c1c(nc(OC[C@@H]2CCCN(CC(C)(C)O)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C30H32N8O2/c1-30(2,39)19-37-11-4-5-21(17-37)18-40-29-35-26(22-8-6-20(14-31)7-9-22)25(28-32-10-12-38(28)29)23-13-24-16-34-36(3)27(24)33-15-23/h6-10,12-13,15-16,21,39H,4-5,11,17-19H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388893
PNG
(4-(8-(1-methyl-1H-indazol-6-yl)-5-{[(3R)-1-methylp...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4cnn(C)c4c3)c3nccn23)C1
Show InChI InChI=1S/C28H27N7O/c1-33-12-3-4-20(17-33)18-36-28-32-26(21-7-5-19(15-29)6-8-21)25(27-30-11-13-35(27)28)22-9-10-23-16-31-34(2)24(23)14-22/h5-11,13-14,16,20H,3-4,12,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388952
PNG
(Methyl (5-{7-(4-cyanophenyl)-5-[4-(dimethylamino)p...)
Show SMILES COC(=O)N(C)c1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H30N8O2/c1-33(2)22-11-14-35(15-12-22)27-32-25(20-7-5-19(17-29)6-8-20)24(26-30-13-16-36(26)27)21-9-10-23(31-18-21)34(3)28(37)38-4/h5-10,13,16,18,22H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389003
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(6-methy...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(C)nc2)c2nccn12
Show InChI InChI=1S/C26H27N7/c1-18-4-7-21(17-29-18)23-24(20-8-5-19(16-27)6-9-20)30-26(33-15-12-28-25(23)33)32-13-10-22(11-14-32)31(2)3/h4-9,12,15,17,22H,10-11,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389026
PNG
(4-[5-{[(3R)-1-(2-hydroxy-2- methylpropyl)piperidin...)
Show SMILES Cn1c2ccc(cc2oc1=O)-c1c(nc(OC[C@@H]2CCCN(CC(C)(C)O)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C31H32N6O4/c1-31(2,39)19-36-13-4-5-21(17-36)18-40-29-34-27(22-8-6-20(16-32)7-9-22)26(28-33-12-14-37(28)29)23-10-11-24-25(15-23)41-30(38)35(24)3/h6-12,14-15,21,39H,4-5,13,17-19H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388929
PNG
(4-[5-[4-(dimethylamino)piperidin-1-yl]-8-(6-methox...)
Show SMILES COc1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H27N7O/c1-31(2)21-10-13-32(14-11-21)26-30-24(19-6-4-18(16-27)5-7-19)23(25-28-12-15-33(25)26)20-8-9-22(34-3)29-17-20/h4-9,12,15,17,21H,10-11,13-14H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388959
PNG
(4-[5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-(6-m...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)nc3)c3nccn23)C1
Show InChI InChI=1S/C26H26N6O/c1-18-5-8-22(15-29-18)23-24(21-9-6-19(14-27)7-10-21)30-26(32-13-11-28-25(23)32)33-17-20-4-3-12-31(2)16-20/h5-11,13,15,20H,3-4,12,16-17H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388967
PNG
(4-[5-{[(3R)-1-(2- cyanoethyl)piperidin-3-yl]methox...)
Show SMILES COc1ncc(cc1F)-c1c(nc(OC[C@@H]2CCCN(CCC#N)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H26FN7O2/c1-37-27-23(29)14-22(16-33-27)24-25(21-7-5-19(15-31)6-8-21)34-28(36-13-10-32-26(24)36)38-18-20-4-2-11-35(17-20)12-3-9-30/h5-8,10,13-14,16,20H,2-4,11-12,17-18H2,1H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389009
PNG
(4-[5-[4-(dimethylamino)piperidin-1- yl]-8-(6-isopr...)
Show SMILES CC(C)c1ccc(cn1)-c1c(nc(N2CCC(CC2)N(C)C)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H31N7/c1-19(2)24-10-9-22(18-31-24)25-26(21-7-5-20(17-29)6-8-21)32-28(35-16-13-30-27(25)35)34-14-11-23(12-15-34)33(3)4/h5-10,13,16,18-19,23H,11-12,14-15H2,1-4H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389010
PNG
(4-{5-{[(3R)-1-ethylpiperidin-3- yl]methoxy}-8-[2-(...)
Show SMILES CCN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3CO)c3nccn23)C1
Show InChI InChI=1S/C29H31N5O2/c1-3-33-13-4-5-22(17-33)19-36-29-32-27(23-9-7-21(16-30)8-10-23)26(28-31-12-14-34(28)29)25-11-6-20(2)15-24(25)18-35/h6-12,14-15,22,35H,3-5,13,17-19H2,1-2H3/t22-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389023
PNG
(4-{8-[5-(difluoromethyl)-6- methylpyridin-3-yl]-5-...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(c2)C(F)F)c2nccn12
Show InChI InChI=1S/C27H27F2N7/c1-17-22(25(28)29)14-20(16-32-17)23-24(19-6-4-18(15-30)5-7-19)33-27(36-13-10-31-26(23)36)35-11-8-21(9-12-35)34(2)3/h4-7,10,13-14,16,21,25H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388897
PNG
(4-[5-{[(3R)-1-methylpyrrolidin-3-yl]methoxy}-8-(6-...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3)c3nccn23)C1
Show InChI InChI=1S/C28H29N7O/c1-33-14-10-21(18-33)19-36-28-32-26(22-6-4-20(16-29)5-7-22)25(27-30-11-15-35(27)28)23-8-9-24(31-17-23)34-12-2-3-13-34/h4-9,11,15,17,21H,2-3,10,12-14,18-19H2,1H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388924
PNG
(4-(8-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidaz...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)n(C)c4c3)c3nccn23)C1
Show InChI InChI=1S/C29H29N7O2/c1-33-13-4-5-20(17-33)18-38-28-32-26(21-8-6-19(16-30)7-9-21)25(27-31-12-14-36(27)28)22-10-11-23-24(15-22)35(3)29(37)34(23)2/h6-12,14-15,20H,4-5,13,17-18H2,1-3H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388931
PNG
(4-{5-[4-(dimethylamino)piperidin-1-yl]-8-[6-(2-oxo...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2ccc(nc2)N2CCCC2=O)c2nccn12
Show InChI InChI=1S/C29H30N8O/c1-34(2)23-11-15-35(16-12-23)29-33-27(21-7-5-20(18-30)6-8-21)26(28-31-13-17-37(28)29)22-9-10-24(32-19-22)36-14-3-4-25(36)38/h5-10,13,17,19,23H,3-4,11-12,14-16H2,1-2H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388949
PNG
(5-{7-(4-cyanophenyl)-5-[4-(dimethylamino)piperidin...)
Show SMILES CN(C)C1CCN(CC1)c1nc(-c2ccc(cc2)C#N)c(-c2cnc(C)c(c2)C#N)c2nccn12
Show InChI InChI=1S/C27H26N8/c1-18-21(16-29)14-22(17-31-18)24-25(20-6-4-19(15-28)5-7-20)32-27(35-13-10-30-26(24)35)34-11-8-23(9-12-34)33(2)3/h4-7,10,13-14,17,23H,8-9,11-12H2,1-3H3
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388960
PNG
(4-(8-(5-fluoro-6-methylpyridin-3-yl)-5-{[(3R)-1-me...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3cnc(C)c(F)c3)c3nccn23)C1
Show InChI InChI=1S/C26H25FN6O/c1-17-22(27)12-21(14-30-17)23-24(20-7-5-18(13-28)6-8-20)31-26(33-11-9-29-25(23)33)34-16-19-4-3-10-32(2)15-19/h5-9,11-12,14,19H,3-4,10,15-16H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388965
PNG
(4-(8-(1-methyl-2-oxo-1,2,3,4- tetrahydroquinolin-7...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4CCC(=O)N(C)c4c3)c3nccn23)C1
Show InChI InChI=1S/C30H30N6O2/c1-34-14-3-4-21(18-34)19-38-30-33-28(23-7-5-20(17-31)6-8-23)27(29-32-13-15-36(29)30)24-10-9-22-11-12-26(37)35(2)25(22)16-24/h5-10,13,15-16,21H,3-4,11-12,14,18-19H2,1-2H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388876
PNG
(4-(8-(4-methylphenyl)-5-{[(3R)-1-methylpyrrolidin-...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(C)cc3)c3nccn23)C1
Show InChI InChI=1S/C26H25N5O/c1-18-3-7-21(8-4-18)23-24(22-9-5-19(15-27)6-10-22)29-26(31-14-12-28-25(23)31)32-17-20-11-13-30(2)16-20/h3-10,12,14,20H,11,13,16-17H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388999
PNG
(4-(8-(6-isopropylpyridin-3-yl)-5- {[(3R)-1-methylp...)
Show SMILES CC(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C28H30N6O/c1-19(2)24-11-10-23(16-31-24)25-26(22-8-6-20(15-29)7-9-22)32-28(34-14-12-30-27(25)34)35-18-21-5-4-13-33(3)17-21/h6-12,14,16,19,21H,4-5,13,17-18H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM389024
PNG
(4-[5-({(3R)-1-[(2R)-2- hydroxypropyl]piperidin-3- ...)
Show SMILES C[C@@H](O)CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C30H30N6O4/c1-19(37)16-35-12-3-4-21(17-35)18-39-29-33-27(22-7-5-20(15-31)6-8-22)26(28-32-11-13-36(28)29)23-9-10-24-25(14-23)40-30(38)34(24)2/h5-11,13-14,19,21,37H,3-4,12,16-18H2,1-2H3/t19-,21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388881
PNG
(4-(8-(1-methyl-2-oxo-2,3-dihydro-1H-indol-5-yl)-5-...)
Show SMILES CN1C(=O)Cc2cc(ccc12)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H28N6O2/c1-33-12-3-4-20(17-33)18-37-29-32-27(21-7-5-19(16-30)6-8-21)26(28-31-11-13-35(28)29)22-9-10-24-23(14-22)15-25(36)34(24)2/h5-11,13-14,20H,3-4,12,15,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388891
PNG
(4-{5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-[6-(...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(nc3)N3CCCC3=O)c3nccn23)C1
Show InChI InChI=1S/C29H29N7O2/c1-34-13-2-4-21(18-34)19-38-29-33-27(22-8-6-20(16-30)7-9-22)26(28-31-12-15-36(28)29)23-10-11-24(32-17-23)35-14-3-5-25(35)37/h6-12,15,17,21H,2-5,13-14,18-19H2,1H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388898
PNG
(4-(8-(1-methyl-2-oxo-2,3-dihydro-1H-indol-5-yl)-5-...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)c3nccn23)C1
Show InChI InChI=1S/C28H26N6O2/c1-32-11-9-19(16-32)17-36-28-31-26(20-5-3-18(15-29)4-6-20)25(27-30-10-12-34(27)28)21-7-8-23-22(13-21)14-24(35)33(23)2/h3-8,10,12-13,19H,9,11,14,16-17H2,1-2H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388998
PNG
(4-(8-(6-ethylpyridin-3-yl)-5-{[(3R)- 1-methylpiper...)
Show SMILES CCc1ccc(cn1)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C27H28N6O/c1-3-23-11-10-22(16-30-23)24-25(21-8-6-19(15-28)7-9-21)31-27(33-14-12-29-26(24)33)34-18-20-5-4-13-32(2)17-20/h6-12,14,16,20H,3-5,13,17-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388896
PNG
(4-(8-[6-(dimethylamino)pyridin-3-yl]-5-{[(3R)-1-me...)
Show SMILES CN(C)c1ccc(cn1)-c1c(nc(OC[C@@H]2CCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C26H27N7O/c1-31(2)22-9-8-21(15-29-22)23-24(20-6-4-18(14-27)5-7-20)30-26(33-13-11-28-25(23)33)34-17-19-10-12-32(3)16-19/h4-9,11,13,15,19H,10,12,16-17H2,1-3H3/t19-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388961
PNG
(Methyl[4-(7-(4-cyanophenyl)-5-{[(3R)-1-methylpiper...)
Show SMILES COC(=O)N(C)c1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C29H29FN6O3/c1-34-13-4-5-20(17-34)18-39-28-33-26(21-8-6-19(16-31)7-9-21)25(27-32-12-14-36(27)28)22-10-11-24(23(30)15-22)35(2)29(37)38-3/h6-12,14-15,20H,4-5,13,17-18H2,1-3H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388970
PNG
(N-[4-(7-(4-cyanophenyl)-5-{[(3R)-1- methylpiperidi...)
Show SMILES CN(Cc1ccc(cc1F)-c1c(nc(OC[C@@H]2CCCN(C)C2)n2ccnc12)-c1ccc(cc1)C#N)S(C)(=O)=O
Show InChI InChI=1S/C29H31FN6O3S/c1-34-13-4-5-21(17-34)19-39-29-33-27(22-8-6-20(16-31)7-9-22)26(28-32-12-14-36(28)29)23-10-11-24(25(30)15-23)18-35(2)40(3,37)38/h6-12,14-15,21H,4-5,13,17-19H2,1-3H3/t21-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388886
PNG
(4-{5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-[4-(...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CCN4CCOCC4)cc3)c3nccn23)C1
Show InChI InChI=1S/C32H36N6O2/c1-36-14-2-3-26(22-36)23-40-32-35-30(28-10-6-25(21-33)7-11-28)29(31-34-13-16-38(31)32)27-8-4-24(5-9-27)12-15-37-17-19-39-20-18-37/h4-11,13,16,26H,2-3,12,14-15,17-20,22-23H2,1H3/t26-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388887
PNG
(4-{5-{[(3R)-1-methylpiperidin-3-yl]methoxy}-8-[4-(...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc(CN4CCOCC4)cc3)c3nccn23)C1
Show InChI InChI=1S/C31H34N6O2/c1-35-13-2-3-25(20-35)22-39-31-34-29(27-10-4-23(19-32)5-11-27)28(30-33-12-14-37(30)31)26-8-6-24(7-9-26)21-36-15-17-38-18-16-36/h4-12,14,25H,2-3,13,15-18,20-22H2,1H3/t25-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388890
PNG
(4-(8-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin...)
Show SMILES CN1CCC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)COc4c3)c3nccn23)C1
Show InChI InChI=1S/C29H28N6O3/c1-33-12-3-4-20(16-33)17-38-29-32-27(21-7-5-19(15-30)6-8-21)26(28-31-11-13-35(28)29)22-9-10-23-24(14-22)37-18-25(36)34(23)2/h5-11,13-14,20H,3-4,12,16-18H2,1-2H3/t20-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM388905
PNG
(4-(8-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-...)
Show SMILES CN1CC[C@@H](COc2nc(-c3ccc(cc3)C#N)c(-c3ccc4n(C)c(=O)oc4c3)c3nccn23)C1
Show InChI InChI=1S/C27H24N6O3/c1-31-11-9-18(15-31)16-35-26-30-24(19-5-3-17(14-28)4-6-19)23(25-29-10-12-33(25)26)20-7-8-21-22(13-20)36-27(34)32(21)2/h3-8,10,12-13,18H,9,11,15-16H2,1-2H3/t18-/m1/s1
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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 US9944647 (2018)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%