Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 14/20 | 1.00 |
| ▸ | NPC1 | O15118 | 14/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 1.00 |
| ▸ | MAPT | P10636 | 10/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 1.00 |
| ▸ | ALOX12 | P18054 | 6/20 | 1.00 |
| ▸ | GAA | P10253 | 2/20 | 1.00 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.85 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.85 |
| ▸ | RELA | Q04206 | 2/20 | 0.85 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.85 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.85 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.85 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.85 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.85 |
| ▸ | HPGD | P15428 | 1/20 | 0.85 |
| ▸ | LMNA | P02545 | 3/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.72 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL12129932 | 0.88 | NPC1 (0.78) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL23114368 | 0.82 | RAB9A (0.91) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL22057898 | 0.81 | ALDH1A1 (0.67) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL22058802 | 0.80 | ALDH1A1 (0.66) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL24178873 | 0.80 | ALDH1A1 (0.66) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5174923 | 0.78 | NPC1 (0.84) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL27181112 | 0.78 | RAB9A (0.85) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL30926503 | 0.78 | RAB9A (0.85) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL19337602 | 0.78 | MAPT (0.63) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL6295679 | 0.77 | NPC1 (1.00) | RAB9ANPC1ALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012037351-A1 | COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |
| WO-2012037349-A2 | COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |