Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | CLK1 | P49759 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25033217 | 0.80 | CA12 (0.41) | KMT2AALDH1A1ALDH3A1MAPTPKM | |
| SCHEMBL30184616 | 0.80 | CA12 (0.41) | KMT2AALDH1A1ALDH3A1MAPTPKM | |
| SCHEMBL25033211 | 0.75 | TOP2B (0.48) | PTGS2KMT2AALDH1A1MAPTTSHR | |
| SCHEMBL25032068 | 0.74 | MEN1 (0.35) | PTGS2KMT2AALDH1A1IDO1ALDH3A1 | |
| SCHEMBL25033617 | 0.72 | PTGS2 (0.42) | PTGS2KMT2AALDH1A1GAA | |
| SCHEMBL29212401 | 0.68 | G6PD (0.53) | PTGS2KMT2AALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL29212409 | 0.68 | GPR119 (0.42) | ALDH1A1ALDH3A1MAPTPDK1PDK2 | |
| SCHEMBL25032065 | 0.66 | IDO1 (0.34) | IDO1GAA | |
| SCHEMBL25032061 | 0.65 | PDE5A (0.43) | KMT2AALDH1A1MAPTTSHRHPGD | |
| SCHEMBL25032069 | 0.65 | IDO1 (0.36) | ALDH1A1IDO1MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023016434-A1 | COMPOUNDS TARGETING MUTANT OF P53 | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2023-02-16 | — | — | WO | disclosed |