Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | HTT | P42858 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5570170 | 1.00 | MEN1 (0.46) | MEN1KMT2APABPC1POLBHSPB1 | |
| SCHEMBL4728753 | 0.86 | HSPB1 (0.58) | MEN1KMT2APABPC1POLBHSPB1 | |
| SCHEMBL24167691 | 0.86 | ALDH1A1 (0.45) | MEN1KMT2APOLBHSPB1ALDH1A1 | |
| SCHEMBL30879433 | 0.86 | ALDH1A1 (0.45) | MEN1KMT2APOLBHSPB1ALDH1A1 | |
| SCHEMBL216106 | 0.85 | MEN1 (0.53) | MEN1KMT2AHSPB1ALDH1A1MAPT | |
| SCHEMBL29888161 | 0.85 | MEN1 (0.53) | MEN1KMT2AHSPB1ALDH1A1MAPT | |
| SCHEMBL29821957 | 0.84 | MEN1 (0.45) | MEN1KMT2APABPC1POLBHSPB1 | |
| SCHEMBL1193081 | 0.83 | PDE7A (0.48) | MEN1KMT2AHSPB1ALDH1A1MAPT | |
| SCHEMBL1192920 | 0.83 | MEN1 (0.49) | MEN1KMT2APOLBHSPB1ALDH1A1 | |
| SCHEMBL1554051 | 0.83 | ALDH1A1 (0.44) | MEN1KMT2APOLBHSPB1ALDH1A1 |
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-117980309-A | Tricyclic fused pyrimidine compounds useful as HER2 inhibitors | 百时美施贵宝公司 | 2024-05-03 | — | — | CN | disclosed |