neridronic acid indications/contra

Stem definitionDrug idCAS RN
calcium metabolism regulator, pharmaceutical aid 3377 79778-41-9

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • neridronic acid
  • neridronate
used for therapy of Paget's disease of bone & malignant hypercalcaemia
  • Molecular weight: 277.15
  • Formula: C6H17NO7P2
  • CLOGP: -4.58
  • LIPINSKI: 1
  • HAC: 8
  • HDO: 6
  • TPSA: 161.31
  • ALOGS: -1.31
  • ROTB: 7

Drug dosage:

None

Approvals:

None

FDA Adverse Event Reporting System

None

Pharmacologic Action:

None

Drug Use (View source of the data)

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DiseaseRelationSNOMED_IDDOID
Humoral hypercalcemia of malignancy indication 47709007
Osteoporosis indication 64859006 DOID:11476

Acid dissociation constants calculated using MoKa v3.0.0

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Dissociation levelDissociation constantType (acidic/basic)
pKa1 1.56 acidic
pKa2 5.63 acidic
pKa3 6.61 acidic
pKa4 10.9 acidic
pKa5 12.94 acidic
pKa6 10.27 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

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TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Farnesyl pyrophosphate synthase Enzyme Ki 7.20 CHEMBL

External reference:

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IDSource
CHEMBL55214 ChEMBL_ID
71237 PUBCHEM_CID
8U27U3RIN4 UNII
6463 INN_ID
CHEBI:135145 CHEBI
C053389 MESH_SUPPLEMENTAL_RECORD_UI
DB11620 DRUGBANK_ID
NRD PDB_CHEM_ID

Pharmaceutical products:

None