Adenosine

Adenosine

SCHEMBL2033282

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 known ✓ P30542 3/20 0.64
▸ ADORA3 known ✓ P0DMS8 1/20 0.64
▸ ADORA2A known ✓ P29274 1/20 0.64
▸ ADORA2B known ✓ P29275 1/20 0.64
▸ P2RY2 P41231 4/20 0.67
▸ P2RY1 P47900 5/20 0.64
▸ SMN1; SMN2 Q16637 3/20 0.64
▸ SRC P12931 2/20 0.64
▸ P2RX1 P51575 2/20 0.64
▸ P2RX3 P56373 2/20 0.64
▸ P2RX2 Q9UBL9 2/20 0.64
▸ P2RX4 Q99571 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.64
▸ DPP4 P27487 1/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ SLC28A1 O00337 1/20 0.64
▸ MAP3K7 O43318 1/20 0.64
▸ SLC28A2 O43868 1/20 0.64
▸ GAPDH P04406 1/20 0.64
▸ MAPK1 P28482 1/20 0.64

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
Adenosine SCHEMBL4070190 1.00 P2RY2 (0.67) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL2349814 1.00 P2RY2 (0.67) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL5476591 0.99 P2RY2 (0.68) P2RY2P2RY1SMN1; SMN2SRCP2RX1
SCHEMBL3164897 0.93 P2RY2 (0.65) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL28240733 0.91 P2RY2 (0.80) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL459770 0.91 P2RY2 (0.80) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL459996 0.91 P2RY2 (0.80) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL29362201 0.91 P2RY2 (0.80) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL9225148 0.90 P2RY2 (0.79) P2RY2P2RY1SMN1; SMN2SRCP2RX1
Adenosine SCHEMBL2210868 0.90 P2RY2 (0.82) P2RY2P2RY1SMN1; SMN2SRCP2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090004101-A1 Method and Means for Enhanced Pulmonary Drug Delivery UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2009-01-01 — — US claimed
US-7256183-B2 Method for treating or preventing inflammatory diseases INSPIRE PHARMACEUTICALS, INC. (US) 2007-08-14 — — US claimed
EP-1786441-A2 METHOD AND MEANS FOR ENHANCED PULMONARY DRUG DELIVERY University College Cardiff Consultants, Ltd. (GB) 2007-05-23 — — EP claimed
WO-2007020018-A1 USE OF PURINERGIC AND PYRIMIDINERGIC RECEPTOR AGONISTS FOR DENDRITIC CELLS BASED IMMUNOTHERAPIES UNIVERSITE LIBRE DE BRUXELLES (BE) 2007-02-22 — — WO claimed
US-7109181-B2 Joint lubrication with P2Y purinergic receptor agonists INSPIRE PHARMACEUTICALS, INC. (US) 2006-09-19 — — US claimed
WO-2006016115-A2 METHOD AND MEANS FOR ENHANCED PULMONARY DRUG DELIVERY UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2006-02-16 — — WO claimed
JP-2005508297-A — — 2005-03-31 — — JP claimed
US-6703376-B2 ADMINISTERING TO THE AIRWAYS OF THE PATIENT A URIDINE PHOSPHATE SUCH AS URIDINE 5'TRIPHOSPHATE OR DI(URIDINE5') TETRAPHOSPHATE FOR PROMOTING DRAINAGE OF MUCOUS SECRETIONS IN THE CONGESTED AIRWAYS OF A BEDRIDDEN/IMMOBILIZED PATIENT INSPIRE PHARMACEUTICALS, INC. 2004-03-09 — — US claimed
US-6696425-B2 STIMULATING TEAR SECRETION AND MUCIN PRODUCTION IN EYES OF A SUBJECT BY ADMINISTERING CERTAIN URIDINE, ADENINE, OR CYTIDINE TRIPHOSPHATES AS WELL AS OTHER DINUCLEOSIDE POLYPHOSPHATE COMPOUNDS INSPIRE PHARMACEUTICALS, INC. 2004-02-24 — — US claimed
US-6596725-B2 Vision defects INSPIRE PHARMACEUTICALS, INC. 2003-07-22 — — US claimed
US-20030125299-A1 Method for treating or preventing inflammatory diseases PETERSON WARD M (US) 2003-07-03 — — US claimed
WO-2003028712-A2 PURINERGIC AND PYRIMIDINERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF ACTIVATED CD4+ T LYMPHOCYTE-MEDIATED IMMUNE DISEASES UNIVERSITE LIBRE DE BRUXELLES (BE) 2003-04-10 — — WO claimed
US-20030027785-A1 Joint lubrication with P2Y purinergic receptor agonists INSPIRE PHARMACEUTICALS, INC. 2003-02-06 — — US claimed
WO-2003000056-A1 JOINT LUBRICATION WITH P2Y PURINERGIC RECEPTOR AGONISTS INSPIRE PHARMACEUTICALS, INC. (US) 2003-01-03 — — WO claimed
US-20020193340-A1 Method of treating dry eye disease with purinergic receptor agonists MERCK SHARP & DOHME CORP. 2002-12-19 — — US claimed
EP-2045257-B1 PROCESS FOR PRODUCING DI(PYRIMIDINE NUCLEOSIDE 5'-)POLYPHOSPHATE YAMASA CORP (JP) 2016-08-17 — — EP disclosed
US-8193338-B2 Process for producing di(pyrimidine nucleoside 5'-)polyphosphate YAMASA CORPORATION (JP) 2012-06-05 — — US disclosed
WO-2003028712-A2 PURINERGIC AND PYRIMIDINERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF ACTIVATED CD4+ T LYMPHOCYTE-MEDIATED IMMUNE DISEASES UNIVERSITE LIBRE DE BRUXELLES (BE) 2003-04-10 — — WO disclosed
US-20020193340-A1 Method of treating dry eye disease with purinergic receptor agonists MERCK SHARP & DOHME CORP. 2002-12-19 — — US disclosed
WO-2002060454-A2 USE OF DINUCLEOSIDE POLYPHOSPHATE TO STIMULATE REMOVAL OF FLUID IN RETINAL DISORDERS INSPIRE PHARMACEUTICALS, INC. (US) 2002-08-08 — — WO 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 (4 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-20020193340-A1 Method of treating dry eye disease with purinergic receptor agonists P2RY1, P2RY12, P2RY2 ADORA1 35/4885ADORA3 43/4885ADORA2A 28/4885
US-20090004101-A1 Method and Means for Enhanced Pulmonary Drug Delivery P2RY1, P2RY6, P2RY2 ADORA1 19/4885ADORA3 16/4885ADORA2A 22/4885
US-20030125299-A1 Method for treating or preventing inflammatory diseases ADORA2B, ADORA2A, P2RY2 ADORA1 10/4885ADORA3 7/4885ADORA2A 2/4885
US-20030027785-A1 Joint lubrication with P2Y purinergic receptor agonists P2RY1, P2RY2, P2RY6 ADORA1 11/4885ADORA3 17/4885ADORA2A 7/4885

“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.

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