Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | IAPP | P10997 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9118435 | 1.00 | GLA (0.44) | GLATDP1IAPPPTGS1POLB | |
| SCHEMBL746977 | 0.84 | HCAR2 (0.48) | GLATDP1POLBHCAR2PADI4 | |
| SCHEMBL746816 | 0.84 | HCAR2 (0.48) | GLATDP1POLBHCAR2PADI4 | |
| SCHEMBL17157645 | 0.82 | POLB (0.43) | POLBHCAR2PADI4HTTGAA | |
| SCHEMBL17157644 | 0.82 | POLB (0.43) | POLBHCAR2PADI4HTTGAA | |
| SCHEMBL745343 | 0.81 | KDM4E (0.50) | POLBHCAR2PADI4HTTGAA | |
| SCHEMBL745342 | 0.81 | KDM4E (0.50) | POLBHCAR2PADI4HTTGAA | |
| SCHEMBL3752783 | 0.81 | AKR1C3 (0.43) | POLBHCAR2PADI4HTTMAPT | |
| SCHEMBL3092230 | 0.81 | AKR1C3 (0.43) | POLBHCAR2PADI4HTTMAPT | |
| SCHEMBL4172750 | 0.81 | KMT2A (0.44) | POLBHCAR2PADI4HTTMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995028400-A1 | NOVEL BENZOFUSED 5-MEMBERED HETEROCYCLIC RINGS FOR THE TREATMENT OF MIGRAINE | GLAXO GROUP LIMITED (GB) | 1995-10-26 | — | — | WO | disclosed |