Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29190669 | 1.00 | MAPK1 (0.52) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL2466571 | 0.90 | MAPK1 (0.52) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL30833680 | 0.89 | MAPK1 (0.43) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL30833677 | 0.89 | MAPK1 (0.43) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL29190586 | 0.89 | MAPK1 (0.43) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL30833799 | 0.85 | SIRT6 (0.50) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL4784574 | 0.85 | SIRT6 (0.50) | MAPK1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL2927346 | 0.79 | CTSB (0.53) | ALDH1A1CYP2C9MEN1KMT2APOLB | |
| SCHEMBL27228014 | 0.78 | KDM4E (0.53) | ALDH1A1HPGDKMT2ATDP1SMN1; SMN2 | |
| SCHEMBL30860970 | 0.78 | KDM4E (0.53) | ALDH1A1HPGDKMT2ATDP1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |