Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 4/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23529797 | 1.00 | IDO1 (0.40) | IDO1LRRK2MAP2K4PIM1AXL | |
| SCHEMBL23529799 | 0.73 | CYP2C19 (0.58) | PIM1ALKALDH1A1CYP2A6KIF11 | |
| SCHEMBL29804344 | 0.73 | CYP2C19 (0.58) | PIM1ALKALDH1A1CYP2A6KIF11 | |
| SCHEMBL38654767 | 0.69 | L3MBTL1 (0.40) | ALDH1A1CYP2A6KIF11CYP1A2CYP2C19 | |
| SCHEMBL5398670 | 0.69 | CHRNB2 (0.44) | CYP2A6CYP1A2TDP1CYP2D6 | |
| SCHEMBL21026893 | 0.65 | GPR84 (0.39) | CYP1A2CYP2C19 | |
| SCHEMBL29804465 | 0.65 | IDO1 (0.49) | IDO1LRRK2MAP2K4PIM1AXL | |
| SCHEMBL23533603 | 0.65 | IDO1 (0.49) | IDO1LRRK2MAP2K4PIM1AXL | |
| SCHEMBL30542272 | 0.63 | CHRNB2 (0.55) | CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2124896 | 0.61 | CYP2A6 (0.48) | IDO1LRRK2MAP2K4PIM1AXL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122010905-A | Pyrazolyl derivatives as anticancer agents | 诺华股份有限公司 | 2026-05-12 | — | — | CN | disclosed |
| CN-114929342-A | Pyrazolyl derivatives as anticancer agents | 诺华股份有限公司 | 2022-08-19 | — | — | CN | disclosed |