Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Theophylline Anhydrous. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A known ✓ | P27815 | 9/20 | 0.81 |
| ▸ | PDE4B known ✓ | Q07343 | 9/20 | 0.81 |
| ▸ | PDE4C known ✓ | Q08493 | 9/20 | 0.81 |
| ▸ | PDE4D known ✓ | Q08499 | 9/20 | 0.81 |
| ▸ | ADORA2A known ✓ | P29274 | 8/20 | 0.81 |
| ▸ | ADORA2B known ✓ | P29275 | 8/20 | 0.81 |
| ▸ | ADORA3 known ✓ | P0DMS8 | 4/20 | 0.81 |
| ▸ | ADORA1 known ✓ | P30542 | 2/20 | 0.81 |
| ▸ | PDE3B known ✓ | Q13370 | 1/20 | 0.58 |
| ▸ | PDE3A known ✓ | Q14432 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 1.00 |
| ▸ | LMNA | P02545 | 1/20 | 1.00 |
| ▸ | MAPT | P10636 | 1/20 | 1.00 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.84 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.81 |
| ▸ | ALPL | P05186 | 1/20 | 0.81 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.81 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.81 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.81 |
| ▸ | CFTR | P13569 | 2/20 | 0.58 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Theophylline Anhydrous SCHEMBL1321168 | 1.00 | CYP1A2 (1.00) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL5181434 | 1.00 | CYP1A2 (1.00) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL5037 | 1.00 | CYP1A2 (1.00) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL1022085 | 0.98 | CYP1A2 (0.97) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL9792548 | 0.98 | CYP1A2 (0.97) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL19987964 | 0.98 | CYP1A2 (0.97) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL7546366 | 0.98 | CYP1A2 (0.97) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL11187438 | 0.98 | CYP1A2 (0.97) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL8719730 | 0.97 | CYP1A2 (0.94) | CYP1A2LMNAMAPTATAD2PDE4A | |
| Theophylline Anhydrous SCHEMBL28274666 | 0.95 | CYP1A2 (0.91) | CYP1A2LMNAMAPTATAD2PDE4A |
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 328 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116799175-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 晖阳(贵州)新能源材料有限公司 | 2023-09-22 | — | — | CN | claimed |
| WO-2023057671-A1 | SEMI-SUBMERSIBLE FLOATING PLATFORM FOR MARINE WIND TURBINE | SENER, INGENIERÍA Y SISTEMAS, S.A. (ES) | 2023-04-13 | — | — | WO | claimed |
| CN-111407792-A | A Chinese medicinal composition for treating allergic rhinitis, rhinitis sicca, chronic rhinitis and sinusitis | 陈韵如 | 2020-07-14 | — | — | CN | claimed |
| WO-2014177729-A1 | SUBMERSIBLE STRUCTURE FOR ACTIVELY SUPPORTING TOWERS OF GENERATORS AND SUB-STATIONS OR SIMILAR ELEMENTS, IN MARITIME FACILITIES | ACS SERVICIOS, COMUNICACIONES Y ENERGÍA S.L. (ES) | 2014-11-06 | — | — | WO | claimed |
| WO-2013007849-A2 | REINFORCED AIRCRAFT FUSELAGE | AIRBUS OPERATIONS, S.L. (ES) | 2013-01-17 | — | — | WO | claimed |
| WO-2012032201-A1 | DEVICE FOR CAPTURING ENERGY FROM SURFACE AND GROUND WATER CURRENTS | IDEAS, PROYECTOS E INNOVACIONES, S.L. (ES) | 2012-03-15 | — | — | WO | claimed |
| US-8070794-B2 | Frangible bridge structure for a stent, and stent including such bridge structures | STENTYS S.A.S. (FR) | 2011-12-06 | — | — | US | claimed |
| WO-2010136624-A1 | AIRCRAFT TAIL CONE WITH FOLDING MOVABLE FAIRING | AIRBUS OPERATIONS, S.L. (ES) | 2010-12-02 | — | — | WO | claimed |
| WO-2010112645-A1 | AIRCRAFT TAIL CONE WITH SLIDING MOVABLE FAIRING | AIRBUS OPERATIONS, S.L. (ES) | 2010-10-07 | — | — | WO | claimed |
| WO-2010112648-A1 | INTEGRATION OF AN AIRCRAFT FAIRING | AIRBUS OPERATIONS, S.L. (ES) | 2010-10-07 | — | — | WO | claimed |
| WO-2006060505-A2 | CAPSAICIN NUTRITIONAL SUPPLEMENT | DACANAY RHODEL G (US) | 2006-06-08 | — | — | WO | claimed |
| WO-2005105566-A1 | ARTICULATED DEVICE FOR CONNECTING SKEGS TO RIGID SURFBOARDS | BERENGUER MONZON PEDRO (ES) | 2005-11-10 | — | — | WO | claimed |
| EP-1578401-A2 | COMPOSITIONS AND METHODS FOR PROMOTING WEIGHT LOSS, THERMOGENESIS, APPETITE SUPPRESSION, LEAN MUSCLE MASS, INCREASING METABOLISM AND BOOSTING ENERGY LEVELS, AND USE AS A DIETARY SUPPLEMENT IN MAMMALS | RTC Research & Development, LLC. (US) | 2005-09-28 | — | — | EP | claimed |
| US-20040077556-A1 | Compositions and methods for promoting weight loss, thermogenesis, appetite suppression, lean muscle mass, increasing metabolism and boosting energy levels, and use as a dietary supplement in mammals | RTC RESEARCH AND DEVELOPMENT, LLC | 2004-04-22 | — | — | US | claimed |
| WO-2003090673-A2 | COMPOSITIONS AND METHODS FOR PROMOTING WEIGHT LOSS, THERMOGENESIS, APPETITE SUPPRESSION, LEAN MUSCLE MASS, INCREASING METABOLISM AND BOOSTING ENERGY LEVELS, AND USE AS A DIETARY SUPPLEMENT IN MAMMALS | RTC RESEARCH & DEVELOPMENT, LLC. (US) | 2003-11-06 | — | — | WO | claimed |
| WO-1995033634-A1 | BACK-VISION SYSTEM FOR VEHICLES | LAMATA CORTES LUIS LEON (ES) | 1995-12-14 | — | — | WO | claimed |
| US-5424297-A | Adenosine dextran conjugates | UNIVERSITY OF VIRGINIA ALUMNI PATENTS FOUNDATION (US) | 1995-06-13 | — | — | US | claimed |
| EP-0425361-A1 | Catheter for artificial pulmonary ventilation of a patient | OVI (FR) | 1991-05-02 | — | — | EP | claimed |
| US-3981398-A | Aid in the management of clinical emergencies in medical and dental practices and other circumstances | Pienaar, Hendrik Lukas (ZA) | 1976-09-21 | — | — | US | claimed |
| US-3957995-A | ADMINISTERING, CEREBRAL VASODILATOR ACTIVITY | PARCOR (FR) | 1976-05-18 | — | — | US | claimed |