Binodenoson

Binodenoson

SCHEMBL724955

Nc1nc(NN=CC2CCCCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA2A

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

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A known ✓ P29274 13/20 0.98
ADORA1 P30542 7/20 0.98
ADORA2B P29275 2/20 0.67
ADORA3 P0DMS8 2/20 0.67

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
Binodenoson SCHEMBL10089218 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL13259764 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL8932230 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL8922719 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL724956 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL940135 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL23898649 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL12877884 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
Binodenoson SCHEMBL29379829 1.00 ADORA2A (0.98) ADORA2AADORA1ADORA2BADORA3
SCHEMBL9346051 0.99 ADORA2A (1.00) ADORA2AADORA1ADORA2BADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130136693-A1 Crystal Forms of 2--Adenosine KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC (US) 2013-05-30 US claimed
US-20110044904-A1 CRYSTAL FORMS OF 2--ADENOSINE KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2011-02-24 US claimed
EP-2257162-A2 CRYSTAL FORMS OF 2-{2-Ý(CYCLOHEXYL)METHYLENE¨HYDRAZINO}ADENOSINE King Pharmaceuticals Research and Development Inc. (US) 2010-12-08 EP claimed
WO-2009108829-A2 CRYSTAL FORMS OF 2-{2-[(CYCLOHEXYL)METHYLENE]HYDRAZINO}ADENOSINE KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. (US) 2009-09-03 WO claimed
US-20160067271-A1 Methods And Compositions For Preventing Or Treating Obesity NORTHEASTERN UNIVERSITY 2016-03-10 US disclosed
US-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN AKRON MOLECULES AG (AT) 2014-11-27 US disclosed
US-8883500-B2 Method of preparing adenosine-resistant anti-tumor T lymphocytes for adoptive immunotherapy NORTHEASTERN UNIVERSITY (US) 2014-11-11 US disclosed
EP-2674161-A1 FMO3 inhibitors for treating pain Akron Molecules GmbH (AT) 2013-12-18 EP disclosed
US-20130324461-A1 METHODS AND COMPOSITIONS FOR PREVENTING OR TREATING OBESITY SITKOVSKY MICHAIL V (US) 2013-12-05 US disclosed
CN-103415286-A Compounds and methods for treating pain AKRON MOLECULES GMBH 2013-11-27 CN disclosed
US-20130252924-A1 Compounds and Methods for Treating Pain AKRON MOLECULES GMBH (AT) 2013-09-26 US disclosed
EP-2637649-A2 COMPOUNDS AND METHODS FOR TREATING PAIN Akron Molecules GmbH (AT) 2013-09-18 EP disclosed
US-20070213296-A1 Compositions and methods for the treatment of immunoinflammatory disorders COMBINATORX, INCORPORATED 2007-09-13 US disclosed
WO-2007089617-A2 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF MUSCULOSKELETAL DISORDERS AND SYMPTOMS ASSOCIATED THEREWITH COMBINATORX, INCORPORATED (US) 2007-08-09 WO disclosed
WO-2007056457-A2 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF MEDICAL CONDITIONS COMBINATORX, INCORPORATED (US) 2007-05-18 WO disclosed
US-20060159621-A1 Method of detecting myocardial dysfunction in patients having a history of asthma or bronchospasm KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2006-07-20 US disclosed
WO-2006076698-A1 METHOD OF DETECTING MYOCARDIAL DYSFUNCTION IN PATIENTS HAVING A HISTORY OF ASTHMA OR BRONCHOSPASM KING PHARMACEUTICALS RESERCH & DEVELOPMENT, INC. (US) 2006-07-20 WO disclosed
EP-0983768-A1 MEDICINAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATOPATHY Nippon Shinyaku Co., Ltd. (JP) 2000-03-08 EP disclosed
US-5278150-A Vasodilation WHITBY RESEARCH, INC. (US) 1994-01-11 US disclosed
EP-0567094-A2 Hydrazoadenosines Discovery Therapeutics, Inc. (US) 1993-10-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130136693-A1 Crystal Forms of 2--Adenosine ADORA2A, NT5C2, ADORA3 ADORA2A 1/4885ADORA1 4/4885ADORA2B 5/4885
US-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN TRPV1, ACHE, OPRL1 ADORA2A 126/4885ADORA1 348/4885ADORA2B 48/4885
US-20130324461-A1 METHODS AND COMPOSITIONS FOR PREVENTING OR TREATING OBESITY ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA1 3/4885ADORA2B 5/4885
US-20060159621-A1 Method of detecting myocardial dysfunction in patients having a history of asthma or bronchospasm TNNI3, BDKRB2, BDKRB1 ADORA2A 293/4885ADORA1 362/4885ADORA2B 60/4885
US-20160067271-A1 Methods And Compositions For Preventing Or Treating Obesity ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA1 3/4885ADORA2B 5/4885
US-20130252924-A1 Compounds and Methods for Treating Pain TRPV1, ACHE, OPRL1 ADORA2A 126/4885ADORA1 348/4885ADORA2B 48/4885
US-20110044904-A1 CRYSTAL FORMS OF 2--ADENOSINE ADORA2A, NT5C2, ADORA3 ADORA2A 1/4885ADORA1 4/4885ADORA2B 5/4885
US-20070213296-A1 Compositions and methods for the treatment of immunoinflammatory disorders MPO, IL5, SERPINA6 ADORA2A 12/4885ADORA1 78/4885ADORA2B 24/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.