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Histone-lysine N-methyltransferase MLL

Name And Classification

ID:  ALA1293299

Type:  SINGLE PROTEIN

Synonyms:   2.1.1.- | 2.1.1.364 | ALL-1 | ALL1 | C-terminal cleavage product of 180 kDa | CXXC-type zinc finger protein 7 | CXXC7 | Cysteine methyltransferase KMT2A | Histone-lysine N-methyltransferase 2A | HRX | HTRX | KMT2A | Lysine N-methyltransferase 2A | MLL | MLL cleavage product C180 | MLL cleavage product N320 | MLL1 | Myeloid/lymphoid or mixed-lineage leukemia | Myeloid/lymphoid or mixed-lineage leukemia protein 1 | N-terminal cleavage product of 320 kDa | p180 | p320 | Trithorax-like protein | TRX1 | Zinc finger protein HRX

Organism:  Homo sapiens

Species Group:  Homo sapiens

Protein Target Classification:   Epigenetic regulator / Writer / Protein methyltransferase

Target Relations

ALA IDRelationshipPref NameTarget Type
ALA2093861SUBSET OFMenin/Histone-lysine N-methyltransferase MLLPROTEIN-PROTEIN INTERACTION
ALA3883320SUBSET OFHistone-lysine N-methyltransferase 2A/WDR5PROTEIN-PROTEIN INTERACTION
ALA3137282SUBSET OFMLL1/ASH2L/RBBP5/WDR5 complexPROTEIN COMPLEX
ALA4106124SUBSET OFMLL1-ASH2L/RbBP5/WDR5/DPY30PROTEIN-PROTEIN INTERACTION

Target Components

DescriptionRelationshipAccession
Histone-lysine N-methyltransferase 2APROTEINQ03164

Associated Active Ligands

  1. Tetrahydrouridine
    ALA6634

    Name:
    SID50105990

    Mol. Formula:
    C16H17N3O4S

    M.W.:
    347.40

    Type:
    Small molecule

    AlogP:
    0.44

    Polar Surface Area:
    112.73

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  2. Tetrahydrouridine
    ALA285540

    Name:
    SID49645864

    Mol. Formula:
    C22H23N3O4

    M.W.:
    393.44

    Type:
    Small molecule

    AlogP:
    3.63

    Polar Surface Area:
    74.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    0

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  3. Tetrahydrouridine
    ALA120768

    Name:
    SID26749015

    Mol. Formula:
    C16H21N3O2

    M.W.:
    287.36

    Type:
    Small molecule

    AlogP:
    1.92

    Polar Surface Area:
    57.36

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  4. Tetrahydrouridine
    ALA1376

    Name:
    SID50086572

    Mol. Formula:
    C20H17FO3S

    M.W.:
    356.42

    Type:
    Small molecule

    AlogP:
    4.37

    Polar Surface Area:
    60.36

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    0

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  5. Tetrahydrouridine
    ALA472334

    Name:
    SID17385950

    Mol. Formula:
    C24H30N4O

    M.W.:
    390.53

    Type:
    Small molecule

    AlogP:
    4.77

    Polar Surface Area:
    62.77

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    0

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  6. Tetrahydrouridine
    ALA1195077

    Name:
    SID26664644

    Mol. Formula:
    C9H10Cl2N2

    M.W.:
    217.10

    Type:
    Small molecule

    AlogP:
    3.21

    Polar Surface Area:
    15.60

    HBA:
    1

    HBD:
    0

    #RO5 Violations:
    0

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  7. Tetrahydrouridine
    ALA1200562

    Name:
    SID855996

    Mol. Formula:
    C26H38O6

    M.W.:
    446.58

    Type:
    Small molecule

    AlogP:
    3.52

    Polar Surface Area:
    100.90

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    0

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  8. Tetrahydrouridine
    ALA1213096

    Name:
    SID26732632

    Mol. Formula:
    C7H11ClN2O

    M.W.:
    174.63

    Type:
    Small molecule

    AlogP:
    0.36

    Polar Surface Area:
    58.28

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.41

    DETAILS
  9. Tetrahydrouridine
    ALA1234751

    Name:
    SID29217838

    Mol. Formula:
    C7H11NO5

    M.W.:
    189.17

    Type:
    Small molecule

    AlogP:
    -0.56

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  10. Tetrahydrouridine
    ALA1299279

    Name:
    SID49645242

    Mol. Formula:
    C16H14N6O2S

    M.W.:
    354.40

    Type:
    Small molecule

    AlogP:
    1.49

    Polar Surface Area:
    115.79

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    0

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS