Isosorbide Dinitrate

Isosorbide Dinitrate

SCHEMBL3864281

O=[N+]([O-])O.O=[N+]([O-])O[C@H]1CO[C@H]2[C@@H]1OC[C@H]2O[N+](=O)[O-]

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GUCY1A1GUCY1A2GUCY1B1GUCY1B2

The experimentally established mechanism targets of Isosorbide Dinitrate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.88
MAPT P10636 1/20 0.76
BCHE P06276 6/20 0.63
GSR P00390 8/20 0.47
CA2 P00918 2/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Isosorbide Dinitrate SCHEMBL918539 1.00 ALDH1A1 (0.88) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL19528695 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL9439417 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL29532755 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL309369 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL8253 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL1553054 0.94 ALDH1A1 (1.00) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL3008938 0.91 ALDH1A1 (0.95) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Dinitrate SCHEMBL714959 0.91 ALDH1A1 (0.95) ALDH1A1MAPTBCHEGSRCA2
Isosorbide Mononitrate SCHEMBL919022 0.91 MAPT (0.93) ALDH1A1MAPTBCHEGSRCA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019191010-A1 PERSONALIZED TREATMENT METHOD FOR CONGESTIVE HEART FAILURE AARDVARK THERAPEUTICS INC. (US) 2019-10-03 WO claimed
US-20060177504-A1 Combination pain medication SUNDHARADAS RENJIT 2006-08-10 US claimed
US-11166931-B2 Induction of arteriogenesis with an NO (nitric oxide) donor G. POHL-BOSKAMP GMBH & CO. KG (DE) 2021-11-09 US disclosed
WO-2019191010-A1 PERSONALIZED TREATMENT METHOD FOR CONGESTIVE HEART FAILURE AARDVARK THERAPEUTICS INC. (US) 2019-10-03 WO disclosed
WO-2019191010-A1 PERSONALIZED TREATMENT METHOD FOR CONGESTIVE HEART FAILURE AARDVARK THERAPEUTICS INC. (US) 2019-10-03 WO disclosed
EP-2877170-B1 INDUCTION OF ARTERIOGENESIS WITH NITROGLYCERINE G POHL BOSKAMP GMBH & CO KG (DE) 2019-04-10 EP disclosed
EP-3412285-A2 INDUCTION OF ARTERIOGENESIS G. Pohl-Boskamp GmbH & Co. KG (DE) 2018-12-12 EP disclosed
US-20170172966-A1 INDUCTION OF ARTERIOGENESIS WITH AN NO (NITRIC OXIDE) DONOR G. POHL-BOSKAMP GMBH & CO. KG (DE) 2017-06-22 US disclosed
US-20150164845-A1 INDUCTION OF ARTERIOGENESIS WITH AN NO (NITRIC OXIDE) DONOR POHL BOSKAMP G GMBH & CO KG (DE) 2015-06-18 US disclosed
EP-2877170-A1 INDUCTION OF ARTERIOGENESIS WITH AN NO (NITRIC OXIDE) DONOR G. Pohl-Boskamp GmbH & Co. KG (DE) 2015-06-03 EP disclosed
US-20150099270-A1 METHOD OF SCREENING PHARMACEUTICALS FOR DRUG INTERACTIONS AND NEPHROTOXICITY DOWLING THOMAS C (US) 2015-04-09 US disclosed
EP-1212053-A1 METHODS OF TREATING AND PREVENTING CONGESTIVE HEART FAILURE WITH HYDRALAZINE COMPOUNDS AND ISOSORBIDE DINITRATE OR ISOSORBIDE MONONITRATE Nitromed, Inc. (US) 2002-06-12 EP disclosed
WO-2001017528-A1 METHODS OF TREATING AND PREVENTING CONGESTIVE HEART FAILURE WITH HYDRALAZINE COMPOUNDS AND ISOSORBIDE DINITRATE OR ISOSORBIDE MONONITRATE NITROMED, INC. (US) 2001-03-15 WO disclosed
US-5952378-A Methods and means for drug administration PHARMACIA & UPJOHN AB (SE) 1999-09-14 US disclosed
EP-0777483-A1 METHODS AND MEANS FOR DRUG ADMINISTRATION Pharmacia AB (SE) 1997-06-11 EP disclosed
WO-1996005840-A1 METHODS AND MEANS FOR DRUG ADMINISTRATION PHARMACIA AB (SE) 1996-02-29 WO disclosed
US-5374430-A Increased density of gastric controlled release unit by means of weighting agent to increase residence time in human stomach LONDON SCHOOL OF PHARMACY (GB) 1994-12-20 US disclosed
EP-0265061-B1 PHARMACEUTICAL FORMULATION London School of Pharmacy Innovations Ltd (GB) 1992-01-08 EP disclosed
US-4938967-A Pharmaceutical formulations LONDON SCHOOL OF PHARMACY INNOVATIONS LTD. (GB) 1990-07-03 US disclosed
EP-0265061-A1 Pharmaceutical formulation London School of Pharmacy Innovations Ltd (GB) 1988-04-27 EP disclosed