Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7321236 | 0.80 | MMP13 (0.44) | ALDH1A1MAPTGAAKDM4EHPGD | |
| SCHEMBL7064924 | 0.79 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTGAAKDM4E | |
| SCHEMBL9089876 | 0.78 | LMNA (0.40) | ALDH1A1LMNAHSP90AA1MAPTKDM4E | |
| SCHEMBL8831581 | 0.77 | ALDH1A1 (0.41) | ALDH1A1LMNAMAPTGAAKDM4E | |
| SCHEMBL9086781 | 0.75 | ALDH1A1 (0.50) | ALDH1A1LMNAMAPTGAAMEN1 | |
| SCHEMBL6383967 | 0.74 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTGAAMEN1 | |
| SCHEMBL9087437 | 0.74 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTGAAKDM4E | |
| SCHEMBL9087027 | 0.73 | ALDH1A1 (0.60) | ALDH1A1LMNAMAPTKDM4ETSHR | |
| SCHEMBL9086317 | 0.72 | ALDH1A1 (0.50) | ALDH1A1LMNAHSP90AA1MAPTGAA | |
| SCHEMBL29274289 | 0.72 | POLB (0.55) | ALDH1A1MAPTGAAKDM4EHPGD |
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-116332779-A | Preparation method of 3, 4-diaminomethyl benzoate | 苏州敬业医药化工有限公司 | 2023-06-27 | — | — | CN | claimed |
| CN-116332779-A | Preparation method of 3, 4-diaminomethyl benzoate | 苏州敬业医药化工有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-116332779-A | Preparation method of 3, 4-diaminomethyl benzoate | 苏州敬业医药化工有限公司 | 2023-06-27 | — | — | CN | disclosed |