Reaction Details | |||
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Target | Glutathione S-transferase P/Lysine-specific histone demethylase 1A [158-852] | ||
Ligand | BDBM254583 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Biological Assay | ||
pH | 7.4±n/a | ||
Temperature | 310.15±n/a K | ||
IC50 | 27±n/a nM | ||
Comments | extracted | ||
Citation | Ortega Muñoz, A; Fyfe, MC; Martinell Pedemonte, M; Estiarte Martínez, M; Valls Vidal, N; Kurz, G; Castro Palomino Laria, JC (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors US Patent US9469597 Publication Date 10/18/2016 | ||
More Info.: | Get all data from this article, Assay Method | ||
Glutathione S-transferase P/Lysine-specific histone demethylase 1A [158-852] | |||
Name: | Glutathione S-transferase P/Lysine-specific histone demethylase 1A [158-852] | ||
Synonyms: | GST-Lysine Specific Demethylase-1 (LSD1) | ||
Type: | Enzyme | ||
Mol. Mass.: | n/a | ||
Description: | n/a | ||
Components: | This complex has 2 components. | ||
Component 1 | |||
Name: | Glutathione S-transferase P | ||
Synonyms: | FAEES3 | GST class-pi | GST3 | GSTP1 | GSTP1-1 | GSTP1_HUMAN | Glutathione S-transferase | Glutathione S-transferase (GST) | Glutathione S-transferase P | Glutathione S-transferase Pi | Glutathione transferase (GST) | ||
Type: | Enzyme | ||
Mol. Mass.: | 23353.53 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P09211 | ||
Residue: | 210 | ||
Sequence: |
| ||
Component 2 | |||
Name: | Lysine-specific histone demethylase 1A [158-852] | ||
Synonyms: | AOF2 | KDM1 | KDM1A | KDM1A_HUMAN | KIAA0601 | LSD1 | Lysine Specific Demethylase-1 (LSD1) | ||
Type: | Enzyme | ||
Mol. Mass.: | 77140.81 | ||
Organism: | Homo sapiens (Human) | ||
Description: | aa 158-852 | ||
Residue: | 695 | ||
Sequence: |
| ||
BDBM254583 | |||
n/a | |||
Name | BDBM254583 | ||
Synonyms: | US9469597, 42 | US9670136, 42 N1-((trans)-2-(4-(1H-indazol-6-yl)phenyl)cyclopropyl)cyclohexane-1,4-diamine | ||
Type | Small organic molecule | ||
Emp. Form. | C22H26N4 | ||
Mol. Mass. | 346.4686 | ||
SMILES | NC1CCC(CC1)N[C@H]1C[C@@H]1c1ccc(cc1)-c1ccc2cn[nH]c2c1 |r,wU:10.12,wD:8.8,(8.68,4.68,;7.34,3.91,;7.34,2.37,;6.01,1.6,;4.68,2.37,;4.68,3.91,;6.01,4.68,;3.34,1.6,;2.01,2.37,;1.24,3.71,;.47,2.37,;-.86,1.6,;-.86,.06,;-2.2,-.71,;-3.53,.06,;-3.53,1.6,;-2.2,2.37,;-4.87,-.71,;-6.2,.06,;-7.53,-.71,;-7.53,-2.25,;-8.68,-3.28,;-8.05,-4.68,;-6.52,-4.52,;-6.2,-3.02,;-4.87,-2.25,)| | ||
Structure |