Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.62 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.51 |
| ▸ | MAPK7 | Q13164 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29191072 | 0.85 | MEN1 (0.70) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL29191071 | 0.83 | AKR1C3 (0.60) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL29191064 | 0.82 | AKR1C3 (0.71) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL29191004 | 0.81 | MEN1 (0.58) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL15711328 | 0.81 | HDAC1 (0.66) | NR1H4HPGDHDAC3HDAC4HDAC1 | |
| SCHEMBL29191067 | 0.81 | AKR1C3 (0.67) | MEN1KMT2AAKR1C3SMYD3ALDH1A1 | |
| SCHEMBL29190998 | 0.81 | MEN1 (0.71) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL29191025 | 0.81 | AKR1C3 (0.70) | MEN1KMT2AAKR1C3SMYD3MAPK7 | |
| SCHEMBL29191009 | 0.81 | MEN1 (0.67) | MEN1KMT2AAKR1C3ALDH1A1LMNA | |
| SCHEMBL29191076 | 0.80 | MEN1 (0.73) | MEN1KMT2AAKR1C3SMYD3MAPK7 |
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-117886734-A | Heterocyclic amide compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2024-04-16 | — | — | CN | disclosed |