Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 7/20 | 0.39 |
| ▸ | NOS2 | P35228 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9308680 | 0.83 | ALOX5 (0.52) | ALOX5CYP2D6 | |
| SCHEMBL9308663 | 0.76 | ALOX5 (0.48) | ALOX5SLC2A1CYP2D6 | |
| SCHEMBL8953851 | 0.75 | SLC2A1 (0.43) | SLC2A1CYP2D6ALDH1A1 | |
| SCHEMBL9309282 | 0.75 | ALOX5 (0.48) | ALOX5CYP2D6 | |
| SCHEMBL9308523 | 0.74 | ALOX5 (0.62) | ALOX5CYP2D6 | |
| SCHEMBL13097002 | 0.73 | MAOB (0.47) | CYP2D6ALDH1A1 | |
| SCHEMBL9307970 | 0.73 | CYP11B1 (0.42) | CYP2D6GPR84 | |
| SCHEMBL9309603 | 0.70 | ALOX5 (0.60) | ALOX5CYP2D6 | |
| SCHEMBL3100940 | 0.70 | LOXL2 (0.41) | GPR84 | |
| SCHEMBL22964264 | 0.69 | SLC2A1 (0.48) | SLC2A1CYP2D6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5354865-A | Enzyme inhibitor and inhibiting the leukotriene biosynthesis | ABBOTT LABORATORIES (US) | 1994-10-11 | — | — | US | disclosed |
| WO-1994005281-A1 | PHENYLMETHYL DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY | ABBOTT LABORATORIES (US) | 1994-03-17 | — | — | WO | disclosed |