Didanosine

Didanosine

SCHEMBL1769151

OC[C@H]1CC[C@@H](n2cnc3c(O)ncnc32)O1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
ALB P02768 1/20 0.61
MAPK1 P28482 1/20 0.61
ABL1 P00519 2/20 0.48
RIN1 Q13671 2/20 0.48
ADA P00813 1/20 0.47
CYP1A2 P05177 1/20 0.47
HIF1A Q16665 1/20 0.45
TDP1 Q9NUW8 1/20 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
Didanosine SCHEMBL3364 1.00 ALDH1A1 (0.61) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL12150307 1.00 ALDH1A1 (0.61) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL7910803 0.99 ALDH1A1 (0.60) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL8709115 0.99 ALDH1A1 (0.60) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL7910809 0.99 ALDH1A1 (0.60) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL7907423 0.97 ALDH1A1 (0.59) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL7907418 0.97 ALDH1A1 (0.59) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL9223571 0.94 ALDH1A1 (0.56) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL8025110 0.94 ALDH1A1 (0.58) ALDH1A1LMNAALBMAPK1ABL1
Didanosine SCHEMBL9594496 0.93 ADA (0.58) ALDH1A1LMNAALBMAPK1ADA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9713622-B2 Schedules for administering combination therapies useful for treating persons afflicted with the human immunodeficiency virus (HIV) UNIVERSITÉ VERSAILLES SAINT-QUENTIN-EN-YVELINES (FR) 2017-07-25 US disclosed
EP-2501386-B1 QUADRUPLE THERAPY USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) Assistance Publique Hôpitaux De Paris (FR) 2016-01-27 EP disclosed
US-20150374727-A1 NOVEL SCHEDULES FOR ADMINISTERING COMBINATION THERAPIES USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) ASSISTANCE PUBLIQUE - HOPITAUX DE PARIS (FR) 2015-12-31 US disclosed
US-20150305983-A1 QUADRUPLE THERAPY USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) UNIVERSITÉ VERSAILLES SAINT-QUENTIN-EN-YVELINES (FR) 2015-10-29 US disclosed
US-9101633-B2 Quadruple therapy useful for treating persons afflicted with the human immunodeficiency virus (HIV) THE UNIVERSITY OF VERSAILLES SAINT-QUENTIN-EN-YVELINES (FR) 2015-08-11 US disclosed
US-20120270828-A1 QUADRUPLE THERAPY USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) THE UNIVERSITY OF VERSAILLES SAINT-QUENTIN-EN-YVELINES (FR) 2012-10-25 US disclosed
EP-2501386-A1 QUADRUPLE THERAPY USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) Assistance Publique Hôpitaux De Paris (FR) 2012-09-26 EP disclosed
EP-2332544-A1 New pharmaceutical composition suitable for treating persons affected by human immunodeficiency virus (HIV) ASSISTANCE PUBLIQUE, HOPITAUX DE PARIS (FR) 2011-06-15 EP disclosed
WO-2011061303-A1 QUADRUPLE THERAPY USEFUL FOR TREATING PERSONS AFFLICTED WITH THE HUMAN IMMUNODEFICIENCY VIRUS (HIV) ASSISTANCE PUBLIQUE - HOPITAUX DE PARIS (FR) 2011-05-26 WO disclosed
EP-0707481-B1 L-2',3'-DIDEOXY NUCLEOSIDE ANALOGS AS ANTI-HEPATITIS B (HBV) AND ANTI-HIV AGENTS UNIV YALE (US) 2000-08-16 EP disclosed
US-5830881-A L-2'3',dideoxy nucleoside analogs as anti-hepatitus B (HBV) agents YALE UNIVERSITY (US) 1998-11-03 US disclosed
US-5631239-A VIRICIDES FOR HEPATITIS YALE UNIVERSITY (US) 1997-05-20 US disclosed
US-5627160-A L-2',3'-dideoxy nucleoside analogs as anti-hepatitis B (HBV) and anti-HIV agents YALE UNIVERSITY (US) 1997-05-06 US disclosed
US-5561120-A LOW TOXICITY TO HOST CELLS YALE UNIVERSITY (US) 1996-10-01 US disclosed
EP-0707481-A4 1996-05-29 EP disclosed
EP-0707481-A1 L-2',3'-DIDEOXY NUCLEOSIDE ANALOGS AS ANTI-HEPATITIS B (HBV) AND ANTI-HIV AGENTS YALE UNIVERSITY (US) 1996-04-24 EP disclosed
WO-1994027616-A1 L-2',3'-DIDEOXY NUCLEOSIDE ANALOGS AS ANTI-HEPATITIS B (HBV) AND ANTI-HIV AGENTS YALE UNIVERSITY (US) 1994-12-08 WO disclosed
US-5011774-A Dideoxyinosine by enzymatic deamination of dideoxyadenosine BRISTOL-MYERS SQUIBB CO. (US) 1991-04-30 US disclosed
EP-0285884-A2 Process to produce 2', 3'-Dideoxynucleosides Bristol-Myers Squibb Company (US) 1988-10-12 EP disclosed