Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 4/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 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 | |
|---|---|---|---|---|
| SCHEMBL455368 | 0.79 | CYP3A4 (0.41) | MEN1KMT2AGAACYP1A2NPC1 | |
| SCHEMBL14005770 | 0.76 | TDP1 (0.41) | CYP1A2TDP1NPC1RAB9AALDH1A1 | |
| SCHEMBL29799251 | 0.76 | BIRC5 (0.48) | MEN1KMT2ACYP1A2NPC1RAB9A | |
| SCHEMBL27872598 | 0.73 | ENPP2 (0.43) | MEN1KMT2AGAAENPP2MKNK1 | |
| Naphthalene SCHEMBL27305592 | 0.73 | CYP1A2 (0.67) | MEN1KMT2ACYP1A2ESR2ESR1 | |
| SCHEMBL599252 | 0.72 | VHL (0.56) | MEN1KMT2AGAAENPP2MKNK1 | |
| SCHEMBL7355823 | 0.71 | ALDH1A1 (0.43) | MEN1KMT2AGAACYP1A2MIF | |
| Anthracene SCHEMBL3464857 | 0.68 | CYP1A2 (0.68) | MEN1KMT2ACYP1A2ESR2ESR1 | |
| Anthracene SCHEMBL27695029 | 0.68 | CYP1A2 (0.68) | MEN1KMT2ACYP1A2ESR2ESR1 | |
| Anthracene SCHEMBL28120397 | 0.68 | CYP1A2 (0.68) | MEN1KMT2ACYP1A2ESR2ESR1 |
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-117623839-A | Biaryl axis chiral pyrrole compound and synthesis method and application thereof | 华中师范大学 | 2024-03-01 | — | — | CN | disclosed |