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Phosphoglycerate kinase

Name And Classification

ID:  ALA2096677

Type:  PROTEIN FAMILY

Synonyms:   2.7.2.3 | Cell migration-inducing gene 10 protein | PGK1 | PGKA | Phosphoglycerate kinase 1 | Primer recognition protein 2 | PRP 2

Organism:  Homo sapiens

Species Group:  Homo sapiens

Protein Target Classification:   Enzyme / Transferase

Target Relations

ALA IDRelationshipPref NameTarget Type
ALA2886SUPERSET OFPhosphoglycerate kinase 1SINGLE PROTEIN

Target Components

DescriptionRelationshipAccession
Phosphoglycerate kinase 1PROTEINP00558
Phosphoglycerate kinase 2PROTEINP07205

Associated Active Ligands

  1. Tetrahydrouridine
    ALA86533

    Name:
    2-[6-Amino-2-(2,2-diphenyl-ethylamino)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol

    Mol. Formula:
    C24H26N6O4

    M.W.:
    462.51

    Type:
    Small molecule

    AlogP:
    1.26

    Polar Surface Area:
    151.57

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  2. Tetrahydrouridine
    ALA87357

    Name:
    2-[6-Amino-2-(3-phenyl-propylamino)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol

    Mol. Formula:
    C19H24N6O4

    M.W.:
    400.44

    Type:
    Small molecule

    AlogP:
    0.06

    Polar Surface Area:
    151.57

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  3. Tetrahydrouridine
    ALA313069

    Name:
    2-(6-Amino-2-benzylamino-purin-9-yl)-5-hydroxymethyl-tetrahydro-furan-3,4-diol

    Mol. Formula:
    C17H20N6O4

    M.W.:
    372.39

    Type:
    Small molecule

    AlogP:
    -0.37

    Polar Surface Area:
    151.57

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  4. Tetrahydrouridine
    ALA88001

    Name:
    (5-Phosphono-pentyl)-phosphonic acid

    Mol. Formula:
    C5H14O6P2

    M.W.:
    232.11

    Type:
    Small molecule

    AlogP:
    0.51

    Polar Surface Area:
    115.06

    HBA:
    2

    HBD:
    4

    #RO5 Violations:
    0

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  5. Tetrahydrouridine
    ALA87788

    Name:
    2-Hydroxy-3-phosphonooxy-propionic acid

    Mol. Formula:
    C3H7O7P

    M.W.:
    186.06

    Type:
    Small molecule

    AlogP:
    -1.46

    Polar Surface Area:
    124.29

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    0

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  6. Tetrahydrouridine
    ALA85343

    Name:
    [(2,2-Difluoro-2-phosphono-ethylcarbamoyl)-difluoro-methyl]-phosphonic acid

    Mol. Formula:
    C4H7F4NO7P2

    M.W.:
    319.04

    Type:
    Small molecule

    AlogP:
    -0.36

    Polar Surface Area:
    144.16

    HBA:
    3

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  7. Tetrahydrouridine
    ALA85883

    Name:
    [(2-Phosphono-ethylcarbamoyl)-methyl]-phosphonic acid

    Mol. Formula:
    C4H11NO7P2

    M.W.:
    247.08

    Type:
    Small molecule

    AlogP:
    -1.54

    Polar Surface Area:
    144.16

    HBA:
    3

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  8. Tetrahydrouridine
    ALA88020

    Name:
    [Difluoro-(2-phosphono-ethylcarbamoyl)-methyl]-phosphonic acid

    Mol. Formula:
    C4H9F2NO7P2

    M.W.:
    283.06

    Type:
    Small molecule

    AlogP:
    -0.95

    Polar Surface Area:
    144.16

    HBA:
    3

    HBD:
    5

    #RO5 Violations:
    0

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  9. Tetrahydrouridine
    ALA87319

    Name:
    (1,1,3,3-Tetrafluoro-2,2-dihydroxy-3-phosphono-propyl)-phosphonic acid

    Mol. Formula:
    C3H6F4O8P2

    M.W.:
    308.01

    Type:
    Small molecule

    AlogP:
    -0.79

    Polar Surface Area:
    155.52

    HBA:
    4

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  10. Tetrahydrouridine
    ALA87078

    Name:
    [2-(2-Phosphono-ethoxy)-ethyl]-phosphonic acid

    Mol. Formula:
    C4H12O7P2

    M.W.:
    234.08

    Type:
    Small molecule

    AlogP:
    -0.64

    Polar Surface Area:
    124.29

    HBA:
    3

    HBD:
    4

    #RO5 Violations:
    0

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS