Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.30 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.30 |
| ▸ | ITGAL | P20701 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6944653 | 0.66 | ALDH1A1 (0.40) | ITGB2ICAM1ITGAL | |
| SCHEMBL1786152 | 0.64 | — | — | |
| SCHEMBL2045706 | 0.64 | — | — | |
| SCHEMBL9912000 | 0.64 | — | — | |
| SCHEMBL715968 | 0.64 | — | — | |
| SCHEMBL29060 | 0.64 | — | — | |
| SCHEMBL574821 | 0.64 | CA1 (0.45) | TSHRCA1CA9 | |
| SCHEMBL755843 | 0.64 | — | — | |
| SCHEMBL3705478 | 0.64 | — | — | |
| SCHEMBL4698695 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0018135-A1 | Xanthine derivatives, a process for their preparation and their use in pharmaceutical compositions | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1980-10-29 | — | — | EP | claimed |
| EP-0173039-A3 | USE OF XANTHINE AND THIOXANTHINE DERIVATIVES FOR THE PREPARATION OF MEDICAMENTS | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1988-09-14 | — | — | EP | disclosed |
| EP-0173039-A2 | Use of xanthine and thioxanthine derivatives for the preparation of medicaments | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1986-03-05 | — | — | EP | disclosed |
| EP-0018135-A1 | Xanthine derivatives, a process for their preparation and their use in pharmaceutical compositions | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1980-10-29 | — | — | EP | disclosed |