Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28360494 | 1.00 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL13902572 | 0.92 | ALDH1A1 (0.66) | ALDH1A1MEN1KMT2ARAB9AHPGD | |
| SCHEMBL28363755 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL28363756 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL28363903 | 0.84 | KMT2A (0.57) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL28360339 | 0.84 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2ARAB9AHPGD | |
| SCHEMBL28498837 | 0.84 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2ARAB9AHPGD | |
| SCHEMBL28363906 | 0.84 | KMT2A (0.57) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL21877489 | 0.83 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL28360134 | 0.83 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110668950-B | Chiral delta-nitroketene compound and asymmetric synthesis method and application thereof | 浙江工业大学 | 2023-03-31 | — | — | CN | disclosed |
| CN-112047905-A | Method for synthesizing 1, 5-diketone compound by air oxidation of dienone | 浙江工业大学 | 2020-12-08 | — | — | CN | disclosed |
| CN-110668950-A | Chiral delta-nitroketene compound and asymmetric synthesis method and application thereof | 浙江工业大学 | 2020-01-10 | — | — | CN | disclosed |