Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.59 |
| ▸ | AURKA | O14965 | 3/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.50 |
| ▸ | CDK1 | P06493 | 2/20 | 0.48 |
| ▸ | KDR | P35968 | 2/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3634270 | 0.77 | HDAC3 (0.74) | HDAC3HDAC1HDAC2HDAC6AURKA | |
| SCHEMBL7670673 | 0.75 | MAPT (0.50) | MAPTMAPK1ALDH1A1GAAKDM4E | |
| 1,4-Dimethoxybenzene SCHEMBL28111450 | 0.75 | MAPT (0.50) | MAPTMAPK1ALDH1A1GAAKDM4E | |
| SCHEMBL30560062 | 0.75 | ALK (0.53) | SYKKDR | |
| SCHEMBL4729588 | 0.74 | HDAC1 (1.00) | HDAC3HDAC1HDAC2HDAC6CHEK1 | |
| SCHEMBL30560065 | 0.73 | SYK (0.55) | HDAC3HDAC1HDAC2HDAC6AURKA | |
| SCHEMBL30560067 | 0.73 | MAP4K1 (0.50) | — | |
| SCHEMBL11461135 | 0.72 | HDAC3 (0.63) | HDAC3HDAC1HDAC2HDAC6AURKA | |
| SCHEMBL22191045 | 0.72 | HDAC3 (0.59) | HDAC3HDAC1HDAC2HDAC6AURKA | |
| SCHEMBL2495024 | 0.72 | NR4A1 (0.61) | HDAC3HDAC1HDAC2HDAC6AURKA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3733184-B1 | PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER | ICAHN SCHOOL MED MOUNT SINAI (US) | 2023-08-30 | — | — | EP | claimed |