Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.49 |
| ▸ | TPX2 | Q9ULW0 | 2/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | RHEB | Q15382 | 8/20 | 0.42 |
| ▸ | AHR | P35869 | 3/20 | 0.41 |
| ▸ | F7 | P08709 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CMA1 | P23946 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7334380 | 0.86 | PRKAB2 (0.38) | AURKATPX2PARP1RHEBPIK3CD | |
| SCHEMBL7336629 | 0.86 | NR4A2 (0.45) | AURKATPX2PARP1RHEBAHR | |
| SCHEMBL7330190 | 0.85 | RHEB (0.46) | AURKATPX2PARP1RHEBAHR | |
| SCHEMBL6321966 | 0.78 | PIK3CD (0.64) | AURKATPX2RHEBAHRPIK3CD | |
| SCHEMBL25903699 | 0.74 | PDE3B (0.55) | ALDH1A1 | |
| SCHEMBL7326270 | 0.73 | MAP3K11 (0.49) | — | |
| SCHEMBL8959626 | 0.72 | TNF (0.48) | PARP1RHEBAHRF7LTA4H | |
| SCHEMBL830446 | 0.71 | RHEB (0.50) | PARP1RHEBAHRF7LTA4H | |
| SCHEMBL31416308 | 0.71 | RHEB (0.50) | PARP1RHEBAHRF7LTA4H | |
| SCHEMBL16341336 | 0.70 | AHR (0.50) | PARP1RHEBAHRPIK3CDALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0674620-A1 | TRYPTAMINE ANALOGUES AS 5-HT 1?-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-10-04 | — | — | EP | disclosed |
| WO-1994014771-A1 | TRYPTAMINE ANALOGUES AS 5-HT1-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-07-07 | — | — | WO | disclosed |