Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GUSB | P08236 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL31428518 | 1.00 | ABCG2 (0.47) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL24976143 | 0.93 | ABCG2 (0.46) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL31428903 | 0.93 | ABCG2 (0.46) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL31428875 | 0.92 | ABCG2 (0.49) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL31428407 | 0.90 | ABCG2 (0.43) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL24975465 | 0.90 | ABCG2 (0.43) | ABCG2GAATP53ABCB1GABRA1 | |
| SCHEMBL24975655 | 0.89 | LMNA (0.44) | ABCG2GAATP53KDM4EMAPT | |
| SCHEMBL24975658 | 0.87 | NPC1 (0.44) | ABCG2GAATP53ABCB1KDM4E | |
| SCHEMBL24975467 | 0.85 | ABCG2 (0.45) | ABCG2ABCB1GABRA1GABRG2GABRB3 | |
| SCHEMBL31428594 | 0.85 | ABCG2 (0.45) | ABCG2ABCB1GABRA1GABRG2GABRB3 |
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-2023008577-A1 | RAS/RAF BINDING INHIBITOR COMPOUND | 国立大学法人神戸大学 | 2023-02-02 | — | — | WO | disclosed |