Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 9/20 | 0.80 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.80 |
| ▸ | PDE2A | O00408 | 2/20 | 0.79 |
| ▸ | PDE1A | P54750 | 2/20 | 0.79 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.79 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.79 |
| ▸ | PDE4A | P27815 | 11/20 | 0.74 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.74 |
| ▸ | PDE4C | Q08493 | 11/20 | 0.74 |
| ▸ | PDE4D | Q08499 | 11/20 | 0.74 |
| ▸ | CFTR | P13569 | 2/20 | 0.71 |
| ▸ | PDE5A | O76074 | 1/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | TSHR | P16473 | 1/20 | 0.71 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.71 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.71 |
| ▸ | SCN1A | P35498 | 1/20 | 0.71 |
| ▸ | PDE6C | P51160 | 1/20 | 0.71 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL9430493 | 0.92 | ADORA2A (0.76) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL9430122 | 0.88 | ADORA2B (0.85) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL10579248 | 0.88 | ADORA2B (1.00) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL5405285 | 0.85 | ADORA2A (0.86) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL9430034 | 0.85 | PDE4A (1.00) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| Isobutylmethylxanthine SCHEMBL50315 | 0.83 | PDE4A (1.00) | ADORA2BADORA2APDE2APDE1APDE1B | |
| Isobutylmethylxanthine SCHEMBL28814716 | 0.83 | PDE4A (1.00) | ADORA2BADORA2APDE2APDE1APDE1B | |
| Isobutylmethylxanthine SCHEMBL7637581 | 0.81 | PDE4A (0.94) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL239725 | 0.81 | CFTR (1.00) | ADORA2BADORA2APDE2APDE1APDE1B | |
| SCHEMBL11073850 | 0.81 | ADORA2B (0.78) | ADORA2BADORA2APDE2APDE1APDE1B |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0502043-B1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR | LVMH RECH (FR) | 1995-03-01 | — | — | EP | claimed |
| EP-0269841-B1 | 1-HYDROXYALKYL XANTHINES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1992-11-11 | — | — | EP | claimed |
| EP-0502043-A1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR. | LVMH RECH (FR) | 1992-09-09 | — | — | EP | claimed |
| WO-1991007945-A1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR | LVMH RECHERCHE (FR) | 1991-06-13 | — | — | WO | claimed |
| EP-0269841-A1 | 1-Hydroxyalkyl xanthines, processes for their preparation and medicaments containing them | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1988-06-08 | — | — | EP | claimed |
| EP-1904020-A2 | NEW SLIMMING COSMETIC COMPOSITIONS | Sederma S.A.S. (FR) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007010478-A2 | SLIMMING COSMETIC COMPOSITIONS | SEDERMA (FR) | 2007-01-25 | — | — | WO | disclosed |
| US-5470579-A | Xanthines, optionally incorporated in liposomes, for promoting skin or hair pigmentation | LVMH, RECHERCHE (FR) | 1995-11-28 | — | — | US | disclosed |
| EP-0502043-B1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR | LVMH RECH (FR) | 1995-03-01 | — | — | EP | disclosed |
| US-5338741-A | Cardiotonic agents | NESTEC S.A. (CH) | 1994-08-16 | — | — | US | disclosed |
| EP-0269841-B1 | 1-HYDROXYALKYL XANTHINES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1992-11-11 | — | — | EP | disclosed |
| EP-0502043-A1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR. | LVMH RECH (FR) | 1992-09-09 | — | — | EP | disclosed |
| US-5053433-A | Photodiesterase inhibitor | SOCIETE ANONYME DITE: L'OREAL (FR) | 1991-10-01 | — | — | US | disclosed |
| WO-1991007945-A1 | UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR | LVMH RECHERCHE (FR) | 1991-06-13 | — | — | WO | disclosed |
| EP-0269841-A1 | 1-Hydroxyalkyl xanthines, processes for their preparation and medicaments containing them | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1988-06-08 | — | — | EP | disclosed |