Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.48 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.48 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.48 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7477209 | 0.86 | SIRT1 (0.41) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL7414170 | 0.86 | ADORA1 (0.52) | SIRT1SIRT3SIRT5ADORA2BADORA2A | |
| SCHEMBL7469763 | 0.83 | ADORA1 (0.40) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL7424268 | 0.83 | SIRT1 (0.50) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL9706596 | 0.79 | ADORA2A (0.41) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL6676076 | 0.79 | HPGD (0.38) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL7471255 | 0.78 | SIRT1 (0.46) | SIRT1SIRT3SIRT5SIRT2ADORA2B | |
| SCHEMBL7095216 | 0.77 | POLB (0.55) | KDM4EALDH1A1CYP1A2CYP3A4HPGD | |
| SCHEMBL7474152 | 0.76 | ADORA1 (0.69) | ADORA2BADORA2AADORA1ADORA3CYP1A2 | |
| SCHEMBL538418 | 0.75 | ADORA2A (0.54) | SIRT1SIRT3SIRT5SIRT2ADORA2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6268373-B1 | ENZYME INHIBITORS | EURO-CELTIQUE S.A. (LU) | 2001-07-31 | — | — | US | disclosed |
| US-6025361-A | EFFECTIVE PDE IV INHIBITORS, ASTHMA | EURO-CELTIQUE, S.A. (LU) | 2000-02-15 | — | — | US | disclosed |
| EP-0799040-A4 | TRISUBSTITUTED THIOXANTHINES | EURO CELTIQUE SA (LU) | 1998-04-01 | — | — | EP | disclosed |
| EP-0799040-A1 | TRISUBSTITUTED THIOXANTHINES | Euroceltique S.A. (LU) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996018400-A1 | TRISUBSTITUTED THIOXANTHINES | EURO-CELTIQUE, S.A. (LU) | 1996-06-20 | — | — | WO | disclosed |