Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 9/20 | 0.49 |
| ▸ | RXRB | P28702 | 8/20 | 0.49 |
| ▸ | RXRG | P48443 | 5/20 | 0.49 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30631225 | 1.00 | RXRA (0.49) | RXRARXRBRXRGFOLH1MRGPRX4 | |
| SCHEMBL29151978 | 0.85 | PIK3CA (0.41) | RXRARXRBRXRGPIK3CAHDAC1 | |
| SCHEMBL29152026 | 0.83 | HDAC1 (0.57) | PIK3CAHDAC1HPGDNPC1RAB9A | |
| SCHEMBL29152046 | 0.83 | RXRA (0.44) | RXRARXRBRXRGPIK3CAHDAC1 | |
| SCHEMBL30631223 | 0.83 | RXRA (0.44) | RXRARXRBRXRGPIK3CAHDAC1 | |
| SCHEMBL30631181 | 0.75 | ELANE (0.41) | PIK3CAHDAC1HPGDNPC1RAB9A | |
| SCHEMBL29152063 | 0.75 | PIK3CA (0.49) | PIK3CAHDAC1 | |
| SCHEMBL30631159 | 0.75 | PIK3CA (0.49) | PIK3CAHDAC1 | |
| SCHEMBL28460296 | 0.73 | ALDH1A1 (0.48) | PIK3CAHDAC1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL19249082 | 0.71 | RXRA (0.48) | RXRARXRBRXRGFOLH1MRGPRX4 |
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-116987061-A | 4-methyl quinazoline derivative, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-11-03 | — | — | CN | disclosed |