Adenosine

Adenosine

SCHEMBL4070190

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(O)OP(=O)(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 SCHEMBL2033282 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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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-20020193340-A1 Method of treating dry eye disease with purinergic receptor agonists MERCK SHARP & DOHME CORP. 2002-12-19 — — US claimed
EP-0200541-B1 IMMUNOCHEMICAL METHOD AND ANALYTICAL COMPOSITION AND ELEMENT FOR DETERMINATION OF CREATINE KINASE-MB EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-10-03 — — EP claimed
EP-0200541-A2 Immunochemical method and analytical composition and element for determination of creatine kinase-MB EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1986-11-05 — — EP claimed
JP-10215895-A — — None — — JP disclosed
JP-5111396-A — — None — — JP disclosed
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 — — EP disclosed
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 — — US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 — — US disclosed
US-20200278346-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ADJACENT ACQUISITION CO., LLC 2020-09-03 — — US disclosed
EP-3681504-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE Icagen, Inc. (US) 2020-07-22 — — EP disclosed
EP-0755254-A1 PREVENTION AND TREATMENT OF ISCHEMIA-REPERFUSION AND ENDOTOXIN-RELATED INJURY USING ADENOSINE AND PURINO RECEPTOR ANTAGONISTS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1997-01-29 — — EP disclosed
EP-0685561-A1 REAGENT FOR ASSAYING CREATINE KINASE IATRON LABORATORIES, INC. (JP) 1995-12-06 — — EP disclosed
WO-1995026728-A1 PREVENTION AND TREATMENT OF ISCHEMIA-REPERFUSION AND ENDOTOXIN-RELATED INJURY USING ADENOSINE AND PURINO RECEPTOR ANTAGONISTS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1995-10-12 — — WO disclosed
JP-H05111396-A METHOD FOR MEASURING ACTIVITY OF CREATINE KINASE AND REAGENT USED THEREFOR ORIENTAL YEAST CO LTD 1993-05-07 — — JP disclosed
WO-1992003122-A1 PREPARATION FOR APPLICATION OF ACTIVE SUBSTANCES IN THE FORM OF MINIMUM-SIZED DROPLETS CEVC GREGOR (DE) 1992-03-05 — — WO disclosed
EP-0200541-B1 IMMUNOCHEMICAL METHOD AND ANALYTICAL COMPOSITION AND ELEMENT FOR DETERMINATION OF CREATINE KINASE-MB EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-10-03 — — EP disclosed
EP-0200541-A2 Immunochemical method and analytical composition and element for determination of creatine kinase-MB EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1986-11-05 — — 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 (1 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

“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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