Nitroglycerin

Nitroglycerin

SCHEMBL7262020

O=[N+]([O-])O.O=[N+]([O-])OCC(CO[N+](=O)[O-])O[N+](=O)[O-]

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GUCY1A1GUCY1A2GUCY1B1GUCY1B2

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

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.41
PTGS1 P23219 2/20 0.41
CA5A P35218 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GSR P00390 1/20 0.32

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
Nitroglycerin SCHEMBL9154265 1.00 PTGS2 (0.41) PTGS2PTGS1CA5ACA5BALDH1A1
Nitroglycerin SCHEMBL920644 0.93 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL15421 0.93 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL10424193 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL7752036 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL28118295 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL7752031 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL3640987 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL3640991 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR
Nitroglycerin SCHEMBL28723109 0.91 PTGS2 (0.40) PTGS2PTGS1ALDH1A1GSR

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3554483-B1 REDUCING SIDE EFFECTS OF SHORT ACTING NO DONORS G POHL BOSKAMP GMBH & CO KG (DE) 2024-01-31 EP disclosed
CN-115038451-A Multimodal compositions and methods of treatment 阿奎斯蒂弗医疗股份有限公司 2022-09-09 CN disclosed
CN-115003279-A Prodrug compositions and methods of treatment 阿奎斯蒂弗医疗股份有限公司 2022-09-02 CN disclosed
CN-113679682-A Nitroglycerin sublingual tablet and preparation method thereof 珠海润都制药股份有限公司 2021-11-23 CN disclosed
CN-112741822-A Transdermal patch delivery system for the dermal or mucosal release of active substances 江苏集萃新型药物制剂技术研究所有限公司 2021-05-04 CN disclosed
CN-111655239-A Shear stress sensitive liposomes 巴塞尔大学 2020-09-11 CN disclosed
US-20200276145-A1 REDUCING SIDE EFFECTS OF SHORT ACTING NO DONORS G. POHL-BOSKAMP GMBH & CO. KG (DE) 2020-09-03 US disclosed
CN-105744983-B Device and method for sustained release of therapeutic agents of low water solubility in solubilizing agents 纳米医学系统公司 2019-12-27 CN disclosed
EP-3554483-A1 REDUCING SIDE EFFECTS OF SHORT ACTING NO DONORS G. Pohl-Boskamp GmbH & Co. KG (DE) 2019-10-23 EP disclosed
WO-2018109131-A1 REDUCING SIDE EFFECTS OF SHORT ACTING NO DONORS G. POHL-BOSKAMP GMBH & CO. KG (DE) 2018-06-21 WO disclosed
WO-2012088597-A1 NITRIC OXIDE AMINO ACID ESTERS FOR ENHANCEMENT OF PHYSICAL OR MUSCULAR PERFORMANCE AND THE TREATMENT OF MUSCULAR OR NEUROMUSCULAR DISEASES ORAL DELIVERY TECHNOLOGY LTD. (CA) 2012-07-05 WO disclosed
CN-1172665-C Combined medicinal preparation of sodium/hydrogen exchange-pump inhibitor and medicine for treatment of angiocardiopathy ���ĵ�˹ҩ��¹����޹�˾ 2004-10-27 CN disclosed
US-6573288-B1 Compounds are inhibitors of the sodium-dependent bicarbonate/chloride ion exchanger which can be used as medicines for the prophylaxis or treatment of a wide range of diseases, for example the treatment and/or prophylaxis of AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-06-03 US disclosed
US-6369069-B1 CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-09 US disclosed
US-5968978-A ANTIARRYTHMIA AGENTS, ANTIISCHEMIC AGENTS, INHIBIT PROLIFERATION OF CELLS HOECHST MARION ROUSSEL DEUTSCHLAND (DE) 1999-10-19 US disclosed
CN-1209316-A Combined medicinal preparation of sodium/hydrogen exchange-pump inhibitor and medicine for treatment of angiocardiopathy HOECHST MARION ROUSSEL DE GMBH (DE) 1999-03-03 CN disclosed