Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2270851 | 0.85 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1RAB9ANPC1KDM4E | |
| SCHEMBL21847327 | 0.85 | ALDH1A1 (0.64) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL9390228 | 0.85 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL11992012 | 0.78 | L3MBTL1 (0.59) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL3410603 | 0.78 | L3MBTL1 (0.60) | ALDH1A1L3MBTL1KMT2AMAPTKDM4E | |
| SCHEMBL12310822 | 0.76 | L3MBTL1 (0.57) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL4303760 | 0.76 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL9390224 | 0.75 | RAB9A (0.46) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 | |
| SCHEMBL5381285 | 0.74 | CYP2D6 (0.45) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL29048377 | 0.73 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1NPSR1RAB9ANPC1 |
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-1994026715-A1 | AMIDINE DERIVATIVES AS GASTRIC ACID SECRETION INHIBITORS | SMITHKLINE BEECHAM PLC (GB) | 1994-11-24 | — | — | WO | disclosed |