Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | PKM | P14618 | 2/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.58 |
| ▸ | MEN1 | O00255 | 6/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.57 |
| ▸ | POLB | P06746 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.57 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9388002 | 0.83 | HCAR1 (0.40) | ALDH1A1MAPTPKMMCL1KMT2A | |
| SCHEMBL6348692 | 0.81 | BRAF (0.72) | ALDH1A1MAPTPKMKMT2AMEN1 | |
| SCHEMBL5789117 | 0.79 | ALDH1A1 (0.51) | ALDH1A1MAPTPKMMCL1KMT2A | |
| SCHEMBL9393805 | 0.79 | ALDH1A1 (0.52) | ALDH1A1MAPTPKMKMT2AMEN1 | |
| SCHEMBL9390364 | 0.78 | HPGD (0.51) | ALDH1A1MAPTKDM4EPOLBHPGD | |
| SCHEMBL9391037 | 0.76 | ALDH1A1 (0.42) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL6095090 | 0.74 | ALDH1A1 (0.70) | ALDH1A1MAPTPKMMCL1KMT2A | |
| SCHEMBL22105477 | 0.73 | MEN1 (0.68) | ALDH1A1MAPTPKMMCL1KMT2A | |
| SCHEMBL21389577 | 0.73 | MEN1 (1.00) | ALDH1A1MAPTPKMMCL1KMT2A | |
| SCHEMBL9385820 | 0.73 | KDM4E (0.38) | ALDH1A1MAPTKMT2AMEN1KDM4E |
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-1994000452-A1 | 7-NEOPENTYL XANTHINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MALESCI ISTITUTO FARMACOBIOLOGICO S.P.A. (IT) | 1994-01-06 | — | — | WO | disclosed |