Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 5/20 | 0.68 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.68 |
| ▸ | HPGD | P15428 | 5/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | HMGCR | P04035 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | PGR | P06401 | 2/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | AR | P10275 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL2260356 | 1.00 | NPC1 (0.68) | NPC1RAB9AHSP90AB1HPGDCYP3A4 | |
| SCHEMBL3709147 | 1.00 | NPC1 (0.68) | NPC1RAB9AHSP90AB1HPGDCYP3A4 | |
| SCHEMBL5477586 | 0.87 | NPC1 (0.70) | NPC1RAB9AHPGDCYP3A4ALDH1A1 | |
| SCHEMBL3658652 | 0.86 | NPC1 (0.64) | NPC1RAB9AHSP90AB1HPGDCYP3A4 | |
| SCHEMBL8665984 | 0.86 | NPC1 (0.63) | NPC1RAB9AHSP90AB1HPGDCYP3A4 | |
| SCHEMBL28085535 | 0.85 | NPC1 (0.53) | NPC1RAB9AHSP90AB1HPGDCYP3A4 | |
| SCHEMBL3048417 | 0.84 | NPC1 (0.66) | NPC1RAB9AHPGDCYP3A4ALDH1A1 | |
| SCHEMBL30263100 | 0.84 | NPC1 (0.66) | NPC1RAB9AHPGDCYP3A4ALDH1A1 | |
| SCHEMBL1938819 | 0.84 | NPC1 (0.68) | NPC1RAB9AHPGDCYP3A4ALDH1A1 | |
| SCHEMBL5624874 | 0.84 | RAB9A (0.66) | NPC1RAB9AHPGDCYP3A4ALDH1A1 |
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-122010914-A | Quinazoline-coumarin compound and preparation method and application thereof | 郑州大学 | 2026-05-12 | — | — | CN | disclosed |