Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.48 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.48 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.48 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.48 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.48 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.47 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.47 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1376797 | 0.86 | NR3C1 (0.52) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL12324316 | 0.85 | MAPK13 (0.50) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL31047680 | 0.84 | SERPINE1 (0.54) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL3117498 | 0.84 | DPP4 (0.53) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL29639239 | 0.84 | PTGS2 (0.59) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL29031853 | 0.82 | PDE3B (0.48) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL1376795 | 0.82 | ALDH1A1 (0.48) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL12323930 | 0.82 | SERPINE1 (0.51) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL5534618 | 0.81 | ALDH1A1 (0.47) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL29773341 | 0.81 | KCNA5 (0.53) | SERPINE1ALDH1A1HPGDKDM4ESMN1; SMN2 |
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-118496166-A | Preparation method of phthalazinone compound | 五邑大学 | 2024-08-16 | — | — | CN | disclosed |
| CN-113666925-B | Method for synthesizing isoindolo [2,1-b ] isoquinoline-5 (7H) -ketone compound | 广州大学 | 2022-05-17 | — | — | CN | disclosed |