Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29231822 | 0.85 | CYP1A2 (0.37) | L3MBTL1CYP1A2POLBCYP2C9CYP2C19 | |
| SCHEMBL23005124 | 0.83 | EPOR (0.40) | PIN1CYP1A2ALDH1A1KMT2AMEN1 | |
| SCHEMBL30106811 | 0.75 | ALDH1A1 (0.42) | PIN1L3MBTL1POLBALDH1A1KMT2A | |
| SCHEMBL30945383 | 0.75 | ALDH1A1 (0.42) | PIN1L3MBTL1POLBALDH1A1KMT2A | |
| SCHEMBL29231911 | 0.75 | ALDH1A1 (0.42) | PIN1L3MBTL1POLBALDH1A1KMT2A | |
| SCHEMBL29231851 | 0.74 | ALDH1A1 (0.38) | ALDH1A1KMT2AMAPK1MEN1SMN1; SMN2 | |
| SCHEMBL23005207 | 0.73 | MEN1 (0.34) | L3MBTL1CYP1A2ALDH1A1KMT2AMEN1 | |
| SCHEMBL23005150 | 0.72 | CHEK1 (0.30) | — | |
| SCHEMBL29231796 | 0.70 | L3MBTL1 (0.30) | L3MBTL1 | |
| SCHEMBL23005185 | 0.70 | FOLH1 (0.32) | — |
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-112218858-B | 2, 6-Diamino-3, 4-dihydropyrimidin-4-one derivatives and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2024-06-18 | — | — | CN | disclosed |