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MLL1-ASH2L/RbBP5/WDR5/DPY30

Name And Classification

ID:  ALA4106124

Type:  PROTEIN-PROTEIN INTERACTION

Synonyms:   BIG3 | BMP2-induced 3-kb gene protein | WD repeat-containing protein 5 | WDR5

Organism:  Homo sapiens

Species Group:  Homo sapiens

Protein Target Classification:   Other nuclear protein

Target Relations

ALA IDRelationshipPref NameTarget Type
ALA5169069OVERLAPS WITHVHL/WDR5PROTEIN-PROTEIN INTERACTION
ALA2093861OVERLAPS WITHMenin/Histone-lysine N-methyltransferase MLLPROTEIN-PROTEIN INTERACTION
ALA1293299SUPERSET OFHistone-lysine N-methyltransferase MLLSINGLE PROTEIN
ALA3883320SUPERSET OFHistone-lysine N-methyltransferase 2A/WDR5PROTEIN-PROTEIN INTERACTION
ALA3137282SUPERSET OFMLL1/ASH2L/RBBP5/WDR5 complexPROTEIN COMPLEX
ALA1075317SUPERSET OFWD repeat-containing protein 5SINGLE PROTEIN

Target Components

DescriptionRelationshipAccession
WD repeat-containing protein 5PROTEINP61964
Histone-lysine N-methyltransferase 2APROTEINQ03164
Set1/Ash2 histone methyltransferase complex subunit ASH2PROTEINQ9UBL3
Retinoblastoma-binding protein 5PROTEINQ15291
Protein dpy-30 homologPROTEINQ9C005

Associated Active Ligands

  1. Tetrahydrouridine
    ALA4632716

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(3-phenylpropyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C27H38N8O5

    M.W.:
    554.65

    Type:
    Unknown

    AlogP:
    -0.30

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  2. Tetrahydrouridine
    ALA4633548

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(4-chlorobenzyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C25H33ClN8O5

    M.W.:
    561.04

    Type:
    Unknown

    AlogP:
    -0.08

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  3. Tetrahydrouridine
    ALA4633905

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(2-aminoethyl)amino)butanoic acid

    Mol. Formula:
    C16H26N8O5

    M.W.:
    410.44

    Type:
    Unknown

    AlogP:
    -2.91

    Polar Surface Area:
    211.89

    HBA:
    12

    HBD:
    6

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  4. Tetrahydrouridine
    ALA4635424

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(1-(3-cyclopentylpropyl)azetidin-3-yl)amino)butanoic acid

    Mol. Formula:
    C25H40N8O5

    M.W.:
    532.65

    Type:
    Unknown

    AlogP:
    -0.21

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  5. Tetrahydrouridine
    ALA4635991

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(2-chlorobenzyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C25H33ClN8O5

    M.W.:
    561.04

    Type:
    Unknown

    AlogP:
    -0.08

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  6. Tetrahydrouridine
    ALA4636460

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(benzofuran-3-ylmethyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C27H34N8O6

    M.W.:
    566.62

    Type:
    Unknown

    AlogP:
    0.01

    Polar Surface Area:
    202.25

    HBA:
    13

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  7. Tetrahydrouridine
    ALA4637676

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(3-chlorobenzyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C25H33ClN8O5

    M.W.:
    561.04

    Type:
    Unknown

    AlogP:
    -0.08

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  8. Tetrahydrouridine
    ALA4638624

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(3,3-diphenylpropyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C33H42N8O5

    M.W.:
    630.75

    Type:
    Unknown

    AlogP:
    1.29

    Polar Surface Area:
    189.11

    HBA:
    12

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  9. Tetrahydrouridine
    ALA4638858

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(3-((3-cyclopentylpropyl)amino)cyclobutyl)amino)butanoic acid

    Mol. Formula:
    C26H42N8O5

    M.W.:
    546.67

    Type:
    Unknown

    AlogP:
    0.22

    Polar Surface Area:
    197.90

    HBA:
    12

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  10. Tetrahydrouridine
    ALA4641078

    Name:
    (S)-2-amino-4-((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)((1-(thiophen-2-ylmethyl)azetidin-3-yl)methyl)amino)butanoic acid

    Mol. Formula:
    C23H32N8O5S

    M.W.:
    532.63

    Type:
    Unknown

    AlogP:
    -0.67

    Polar Surface Area:
    189.11

    HBA:
    13

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS