Pentaerythritol Tetranitrate

Pentaerythritol Tetranitrate

SCHEMBL920358

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GUCY1A1GUCY1A2GUCY1B1GUCY1B2

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

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 1.00
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
Pentaerythritol Tetranitrate SCHEMBL37177 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTDP1
Pentaerythritol Tetranitrate SCHEMBL5940085 0.97 ALDH1A1 (0.94) ALDH1A1
SCHEMBL7888554 0.92 ALDH1A1 (0.84) ALDH1A1
Pentaerythritol Tetranitrate SCHEMBL1028496 0.92 ALDH1A1 (0.84) ALDH1A1
Pentaerythritol Tetranitrate SCHEMBL15543872 0.87 ALDH1A1 (0.76) ALDH1A1TSHR
SCHEMBL7891079 0.87 ALDH1A1 (0.76) ALDH1A1
Pentaerythritol Tetranitrate SCHEMBL6686407 0.85 ALDH1A1 (0.73) ALDH1A1TSHR
Pentrinitrol SCHEMBL122322 0.84 ALDH1A1 (0.71) ALDH1A1TDP1
SCHEMBL7894787 0.84 ALDH1A1 (0.71) ALDH1A1
SCHEMBL8277378 0.84 ALDH1A1 (0.71) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11389534-B2 Methods of treating a subject for a condition PALO ALTO INVESTORS (US) 2022-07-19 US disclosed
US-10946197-B2 Treatment of conditions through modulation of the autonomic nervous system PALO ALTO INVESTORS (US) 2021-03-16 US disclosed
US-10702533-B2 Treatment of conditions through pharmacological modulation of the autonomic nervous system PALO ALTO INVESTORS (US) 2020-07-07 US disclosed
US-10086071-B2 Methods of treating a subject for a condition PALO ALTO INVESTORS (US) 2018-10-02 US disclosed
US-20170128457-A1 Treatment of Conditions Through Pharmacological Modulation of the Autonomic Nervous System PALO ALTO INVESTORS 2017-05-11 US disclosed
US-9585851-B2 Treatment of conditions through pharmacological modulation of the autonomic nervous system PALO ALTO INVESTORS (US) 2017-03-07 US disclosed
US-20160367807-A1 Treatment of Conditions Through Modulation of the Autonomic Nervous System PALO ALTO INVESTORS 2016-12-22 US disclosed
US-20140086872-A1 Methods of Treating a Subject for a Condition PALO ALTO INVESTORS (US) 2014-03-27 US disclosed
US-8569277-B2 Methods of treating a subject for a condition PALO ALTO INVESTORS (US) 2013-10-29 US disclosed
US-20120270876-A1 Treatment of Conditions Through Pharmacological Modulation of the Autonomic Nervous System PALO ALTO INVESTORS 2012-10-25 US disclosed
US-7738952-B2 Treatment of conditions through modulation of the autonomic nervous system PALO ALTO INVESTORS (US) 2010-06-15 US disclosed
US-20100119482-A1 Treatment of Conditions Through Modulation of the Autonomic Nervous System During at Least One Predetermined Menstrual Cycle Phase PALO ALTO INVESTORS 2010-05-13 US disclosed
US-7363076-B2 Treatment of conditions through modulation of the autonomic nervous system PALO ALTO INVESTORS (US) 2008-04-22 US disclosed
WO-2007075151-A1 COMPOSITE VASODILATOR BASED ON A NO-GROUP DONATOR AND A PROMOTER KUTNYAK VICTOR PAVLOVICH (UA) 2007-07-05 WO disclosed
US-20060034847-A1 Methods of treating a subject for a condition PALO ALTO INVESTORS 2006-02-16 US disclosed
US-20050256028-A1 Treatment of conditions through modulation of the autonomic nervous system during at least one predetermined menstrual cycle phase PALO ALTO INVESTORS 2005-11-17 US disclosed
US-20050240241-A1 Treatment of conditions through modulation of the autonomic nervous system PALO ALTO INVESTORS 2005-10-27 US disclosed
US-20050153885-A1 administering aldosterone antagonists such as spironolactone and eplerenone, to increasing the parasympathetic and sympathetic activity PALO ALTO INVESTORS 2005-07-14 US disclosed
US-20050143378-A1 Treatment of conditions through pharmacological modulation of the autonomic nervous system PALO ALTO INVESTORS 2005-06-30 US disclosed
US-20050021092-A1 Treatment of conditions through modulation of the autonomic nervous system PALO ALTO INVESTORS 2005-01-27 US disclosed