Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 12/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29921963 | 0.90 | NPC1 (0.37) | KRASKDM4EALDH1A1 | |
| SCHEMBL23043008 | 0.90 | NPC1 (0.37) | KRASKDM4EALDH1A1 | |
| SCHEMBL31497664 | 0.77 | KEAP1 (0.32) | KDM4EALDH1A1DHODH | |
| SCHEMBL26965094 | 0.76 | HAVCR2 (0.49) | KRASHSD17B10KDM4EMEN1ALDH1A1 | |
| SCHEMBL29121526 | 0.74 | MAPT (0.44) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL26708861 | 0.70 | AURKB (0.40) | KDM4EMEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL29680567 | 0.68 | NR4A2 (0.40) | KRASKDM4E | |
| SCHEMBL23043368 | 0.68 | NR4A2 (0.40) | KRASKDM4E | |
| SCHEMBL28782012 | 0.67 | KRAS (0.38) | KRAS | |
| SCHEMBL22208213 | 0.66 | KDM4E (0.35) | HSD17B10KDM4EMEN1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-114615981-A | KRAS G12D inhibitors | 米拉蒂治疗股份有限公司 | 2022-06-10 | — | — | CN | disclosed |