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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 105611   
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 [151-852]


(Homo sapiens (Human))
BDBM105611
PNG
(US10047086, 114 | US10640503, Example 114 | US9695...)
Show SMILES CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)n3cncc23)C1 |r|
Show InChI InChI=1S/C31H31N5O2/c1-3-35-12-4-5-22(18-35)19-38-29-15-26(23-8-6-21(16-32)7-9-23)31(36-20-33-17-28(29)36)24-10-11-27-25(13-24)14-30(37)34(27)2/h6-11,13,15,17,20,22H,3-5,12,14,18-19H2,1-2H3/t22-/m1/s1
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PC sid
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Similars

US Patent
n/an/a<50n/an/an/an/a7.525



Incyte Corporation

US Patent


Assay Description
LANCE LSD1/KDM1A demethylase assay¿10 uL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 mM Na...


US Patent US9695168 (2017)


BindingDB Entry DOI: 10.7270/Q2SX6BCD
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM105611
PNG
(US10047086, 114 | US10640503, Example 114 | US9695...)
Show SMILES CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)n3cncc23)C1 |r|
Show InChI InChI=1S/C31H31N5O2/c1-3-35-12-4-5-22(18-35)19-38-29-15-26(23-8-6-21(16-32)7-9-23)31(36-20-33-17-28(29)36)24-10-11-27-25(13-24)14-30(37)34(27)2/h6-11,13,15,17,20,22H,3-5,12,14,18-19H2,1-2H3/t22-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<50n/an/an/an/an/an/a



Incyte Corporation

US Patent


Assay Description
LANCE LSD1/KDM1A demethylase assay-10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 ...


US Patent US10640503 (2020)


BindingDB Entry DOI: 10.7270/Q2D79FFC
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM105611
PNG
(US10047086, 114 | US10640503, Example 114 | US9695...)
Show SMILES CCN1CCC[C@@H](COc2cc(-c3ccc(cc3)C#N)c(-c3ccc4N(C)C(=O)Cc4c3)n3cncc23)C1 |r|
Show InChI InChI=1S/C31H31N5O2/c1-3-35-12-4-5-22(18-35)19-38-29-15-26(23-8-6-21(16-32)7-9-23)31(36-20-33-17-28(29)36)24-10-11-27-25(13-24)14-30(37)34(27)2/h6-11,13,15,17,20,22H,3-5,12,14,18-19H2,1-2H3/t22-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<50n/an/an/an/a7.5n/a



Incyte Corporation

US Patent


Assay Description
LANCE LSD1/KDM1A demethylase assay-10 μL of 1 nM LSD-1 enzyme (ENZO BML-SE544-0050) in the assay buffer (50 mM Tris, pH 7.5, 0.01% Tween-20, 25 ...


US Patent US10047086 (2018)


BindingDB Entry DOI: 10.7270/Q28917W4
More data for this
Ligand-Target Pair