Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2682985 | 0.74 | NPSR1 (0.31) | — | |
| SCHEMBL6552301 | 0.73 | PGR (0.38) | MAOBPTGESAHR | |
| SCHEMBL7732160 | 0.72 | — | — | |
| SCHEMBL7723225 | 0.70 | PTGES (0.35) | MAOBPTGESPPARGAHR | |
| SCHEMBL7732592 | 0.70 | PTGES (0.35) | MAOBPTGESAHR | |
| SCHEMBL7738975 | 0.70 | SKP2 (0.44) | NPC1GAANFKB1RAB9ANFKB2 | |
| SCHEMBL3743046 | 0.66 | TDP1 (0.35) | PPARG | |
| SCHEMBL862322 | 0.65 | CNR1 (0.36) | NPC1GAANFKB1RAB9ANFKB2 | |
| SCHEMBL14862508 | 0.64 | PGR (0.39) | AHR | |
| SCHEMBL2963953 | 0.64 | NPC1 (0.40) | NPC1GAANFKB1RAB9ANFKB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6403638-B1 | COMPOUND FOR USE IN TREATING SKIN DISEASES AND DISORDERS, AND FOR TREATING HYPERVITAMINOSIS A SYNDROME | ALLERGAN SALES, INC. | 2002-06-11 | — | — | US | disclosed |