Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15609264 | 0.82 | MEN1 (0.37) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL15609128 | 0.82 | PIM1 (0.41) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL27980019 | 0.82 | GAA (0.43) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL15164789 | 0.80 | KDM4E (0.33) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL15608733 | 0.79 | MEN1 (0.34) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL15608773 | 0.78 | MEN1 (0.34) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL21553294 | 0.77 | CYP2C9 (0.37) | MEN1KMT2AGAACYP2C9CYP3A4 | |
| SCHEMBL21553343 | 0.76 | CYP2C9 (0.38) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL21553240 | 0.75 | MEN1 (0.38) | MEN1KMT2AGAACYP2C9PKM | |
| SCHEMBL21553265 | 0.75 | CYP2A6 (0.40) | MEN1KMT2AGAACYP2C9PKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111484482-B | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2022-06-21 | — | — | CN | disclosed |
| CN-111484482-A | Alkynyl pyrimidine or alkynyl pyridine compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2020-08-04 | — | — | CN | disclosed |