Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | GAA | P10253 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13425646 | 0.87 | SMN1; SMN2 (0.56) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C | |
| SCHEMBL3396126 | 0.85 | PDE1C (0.69) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C | |
| SCHEMBL3395226 | 0.83 | ALDH1A1 (0.67) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C | |
| SCHEMBL3395069 | 0.82 | ALDH1A1 (0.56) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C | |
| SCHEMBL3395681 | 0.74 | PDE1C (0.60) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C | |
| SCHEMBL3394058 | 0.74 | ALDH1A1 (0.71) | ALDH1A1GAASMN1; SMN2L3MBTL1HTT | |
| SCHEMBL29531249 | 0.74 | ALDH1A1 (0.71) | ALDH1A1GAASMN1; SMN2L3MBTL1HTT | |
| SCHEMBL19752716 | 0.74 | ALDH1A1 (0.71) | ALDH1A1GAASMN1; SMN2L3MBTL1HTT | |
| SCHEMBL10606377 | 0.72 | ALDH1A1 (0.50) | ALDH1A1GAASMN1; SMN2L3MBTL1HTT | |
| SCHEMBL3392505 | 0.72 | MEN1 (0.58) | ALDH1A1GAASMN1; SMN2L3MBTL1PDE1C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |