Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2453493 | 0.86 | ACHE (0.49) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL2452186 | 0.83 | ACHE (0.47) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL2454846 | 0.83 | S100B (0.56) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL28227136 | 0.78 | KDM4E (0.42) | ALDH1A1CA12CA2CA9KMT2A | |
| SCHEMBL12633723 | 0.78 | ALDH1A1 (0.74) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL11557679 | 0.78 | ALDH1A1 (0.74) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL20186922 | 0.78 | ALDH1A1 (0.74) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL255410 | 0.78 | ALDH1A1 (0.74) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL11588746 | 0.78 | ALDH1A1 (0.74) | ALDH1A1PTGS2CA12CA2CA9 | |
| SCHEMBL11407087 | 0.77 | ALDH1A1 (0.55) | ALDH1A1PTGS2CA12CA2CA9 |
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-4082686-A | LIQUID CRYSTAL COMPOSITION | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JA) | 1978-04-04 | — | — | US | disclosed |