Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 7/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.55 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | ACP1 | P24666 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29230206 | 1.00 | SOS1 (0.59) | SOS1ABCG2NPY5REGFRACP1 | |
| SCHEMBL29230173 | 0.86 | SOS1 (0.47) | SOS1ABCG2NPY5REGFRAPP | |
| SCHEMBL30944951 | 0.86 | SOS1 (0.47) | SOS1ABCG2NPY5REGFRAPP | |
| SCHEMBL30944947 | 0.80 | EGFR (0.56) | ABCG2EGFRMEN1KMT2AAPP | |
| SCHEMBL29230121 | 0.80 | EGFR (0.56) | ABCG2EGFRMEN1KMT2AAPP | |
| SCHEMBL29230148 | 0.78 | GAA (0.54) | ABCG2NPY5RMEN1KMT2ANPC1 | |
| SCHEMBL6071332 | 0.76 | ACP1 (0.63) | SOS1ABCG2EGFRACP1RXFP1 | |
| SCHEMBL22321920 | 0.76 | SOS1 (0.72) | SOS1ABCG2NPY5REGFRACP1 | |
| SCHEMBL29490044 | 0.76 | SOS1 (0.72) | SOS1ABCG2NPY5REGFRACP1 | |
| SCHEMBL22343365 | 0.75 | SOS1 (0.74) | SOS1ABCG2NPY5REGFRRXFP1 |
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-118146151-A | 4-Trifluoromethyl substituted quinoline and quinazoline compound and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2024-06-07 | — | — | CN | disclosed |