Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | PIM1 | P11309 | 3/20 | 0.44 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 2/20 | 0.38 |
| ▸ | CLK3 | P49761 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23533603 | 1.00 | IDO1 (0.49) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL23529759 | 0.72 | TGFBR1 (0.37) | — | |
| SCHEMBL38655419 | 0.71 | LRRK2 (0.47) | LRRK2PIM1ALDH1A1CYP1A2NTRK1 | |
| SCHEMBL4378610 | 0.68 | MAP2K4 (0.68) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL2375234 | 0.66 | KDM4E (0.45) | IDO1MAP2K4ALDH1A1TTKALPL | |
| SCHEMBL30725847 | 0.66 | IDO1 (1.00) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL2124896 | 0.66 | CYP2A6 (0.48) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL12318034 | 0.66 | IDO1 (1.00) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL9394628 | 0.66 | IDO1 (0.56) | IDO1LRRK2PIM1MAP2K4AXL | |
| SCHEMBL23533564 | 0.66 | CYP1A2 (0.63) | PIM1ALDH1A1CYP2A6CYP1A2CYP3A4 |
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 |