Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | MEN1 | O00255 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.67 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.67 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.67 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL165611 | 0.90 | ALDH1A1 (0.72) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL168734 | 0.87 | ALDH1A1 (0.69) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL12467306 | 0.87 | ALDH1A1 (0.72) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL256654 | 0.86 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL168039 | 0.86 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL167636 | 0.86 | ALDH1A1 (0.77) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL168699 | 0.86 | ALDH1A1 (0.90) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL1542223 | 0.86 | PKM (0.63) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL168012 | 0.85 | ALDH1A1 (0.69) | ALDH1A1MEN1KMT2ATDP1ALOX12 | |
| SCHEMBL168590 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MEN1KMT2ATDP1ALOX12 |
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-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |