Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2558133 | 0.84 | HSD17B10 (0.66) | POLBALDH1A1HPGDCYP3A4MAPK1 | |
| SCHEMBL7368806 | 0.82 | POLB (0.79) | POLBALDH1A1HPGDHTTHSD17B10 | |
| SCHEMBL5730634 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HPGDCYP3A4MAPK1HTT | |
| SCHEMBL7373176 | 0.81 | CYP3A4 (0.48) | POLBALDH1A1HPGDCYP3A4MAPK1 | |
| SCHEMBL1350452 | 0.81 | ALDH1A1 (0.54) | ALDH1A1HPGDCYP3A4MAPK1HSD17B10 | |
| SCHEMBL20232560 | 0.81 | POLB (0.71) | POLBALDH1A1HPGDHTTHSD17B10 | |
| SCHEMBL30436820 | 0.81 | HSD17B10 (0.71) | POLBHSD17B10MTNR1AMTNR1B | |
| SCHEMBL491188 | 0.81 | HSD17B10 (0.71) | POLBHSD17B10MTNR1AMTNR1B | |
| SCHEMBL14864225 | 0.80 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP3A4MAPK1HTT | |
| SCHEMBL6583328 | 0.80 | ALDH1A1 (0.53) | POLBALDH1A1HPGDCYP3A4MAPK1 |
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-1000031-A4 | VITRONECTIN RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM CORP (US) | 2001-08-16 | — | — | EP | disclosed |
| US-6239138-B1 | TREATMENT OF INFLAMMATION, CANCER, CARDIOVASCULAR DISORDERS, SUCH AS ATHEROSCLEROSIS AND RESTENOSIS, OSTEOPOROSIS, BENZOCYCLOHEPTENYL IN WHICH A NITROGEN-CONTAINING SUBSTITUENT IS PRESENT ON THE AROMATIC SIX-MEMBERED RING AND AN ALIPHATIC | SMITHKLINE BEECHAM CORPORATION | 2001-05-29 | — | — | US | disclosed |
| EP-1000031-A1 | VITRONECTIN RECEPTOR ANTAGONIST | SmithKline Beecham Corporation (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999005107-A1 | VITRONECTIN RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM CORPORATION (US) | 1999-02-04 | — | — | WO | disclosed |