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Neurogenic locus notch homolog protein 1

Name And Classification

ID:  ALA2146346

Type:  SINGLE PROTEIN

Synonyms:   hN1 | Neurogenic locus notch homolog protein 1 | NEXT | NICD | Notch 1 | Notch 1 extracellular truncation | Notch 1 intracellular domain | NOTCH1 | TAN1 | Translocation-associated notch protein TAN-1

Organism:  Homo sapiens

Species Group:  Homo sapiens

Protein Target Classification:   Membrane receptor

Target Relations

ALA IDRelationshipPref NameTarget Type
ALA4524007SUBSET OFNotch receptorPROTEIN FAMILY

Target Components

DescriptionRelationshipAccession
Neurogenic locus notch homolog protein 1PROTEINP46531

Associated Active Ligands

  1. Tetrahydrouridine
    ALA3410163

    Name:
    (2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(trifluoromethyl)phenyl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C30H26F6N4O3

    M.W.:
    604.55

    Type:
    Small molecule

    AlogP:
    5.19

    Polar Surface Area:
    104.86

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  2. Tetrahydrouridine
    ALA3410164

    Name:
    (2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(trifluoromethoxy)phenyl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C30H26F6N4O4

    M.W.:
    620.55

    Type:
    Small molecule

    AlogP:
    5.07

    Polar Surface Area:
    114.09

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  3. Tetrahydrouridine
    ALA3410165

    Name:
    (2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(methylsulfonyl)phenyl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C30H29F3N4O5S

    M.W.:
    614.65

    Type:
    Small molecule

    AlogP:
    3.57

    Polar Surface Area:
    139.00

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  4. Tetrahydrouridine
    ALA3410166

    Name:
    (2R,3R)-3-(4-methoxyphenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C30H29F3N4O4

    M.W.:
    566.58

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    114.09

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  5. Tetrahydrouridine
    ALA3410167

    Name:
    (2R,3R)-3-(4-fluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C29H26F4N4O3

    M.W.:
    554.54

    Type:
    Small molecule

    AlogP:
    4.31

    Polar Surface Area:
    104.86

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. Tetrahydrouridine
    ALA3410168

    Name:
    (2R,3R)-3-(3,4-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C29H25F5N4O3

    M.W.:
    572.53

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    104.86

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  7. Tetrahydrouridine
    ALA3410169

    Name:
    (2R,3R)-3-(2,4-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C29H25F5N4O3

    M.W.:
    572.53

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    104.86

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  8. Tetrahydrouridine
    ALA3410170

    Name:
    (2R,3R)-3-(3,5-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide

    Mol. Formula:
    C29H25F5N4O3

    M.W.:
    572.53

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    104.86

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  9. Tetrahydrouridine
    ALA3890931

    Name:
    US9427442, 21

    Mol. Formula:
    C27H29F5N4O4

    M.W.:
    568.54

    Type:
    Small molecule

    AlogP:
    4.42

    Polar Surface Area:
    122.88

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  10. Tetrahydrouridine
    ALA3891599

    Name:
    US9273014, 7

    Mol. Formula:
    C26H25ClF6N4O3

    M.W.:
    590.95

    Type:
    Small molecule

    AlogP:
    5.28

    Polar Surface Area:
    113.65

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS