Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.56 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.56 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | MPO | P05164 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | DAO | P14920 | 2/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17967278 | 0.84 | MKNK1 (0.54) | MKNK1MKNK2LTA4HMPODAO | |
| SCHEMBL3499891 | 0.81 | HPGD (0.59) | MPOKDRGFERALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL17397945 | 0.80 | HPGD (0.57) | MPOKDRGFERALDH1A1MEN1 | |
| SCHEMBL4853841 | 0.78 | DYRK1A (0.59) | LTA4HMPOKDRNPC1MAPT | |
| SCHEMBL3259505 | 0.72 | SCN9A (0.41) | DAONPC1MAPTRAB9AALDH1A1 | |
| SCHEMBL5630086 | 0.72 | MKNK1 (1.00) | MKNK1MKNK2LTA4HNPC1MAPT | |
| SCHEMBL13737504 | 0.71 | HSP90AB1 (0.53) | MKNK1MKNK2MPOHSP90AB1DAO | |
| SCHEMBL3937754 | 0.68 | MAPT (0.49) | MPODAONPC1MAPTRAB9A | |
| SCHEMBL10284906 | 0.68 | HSP90AB1 (0.45) | HSP90AB1DAONPC1MAPTRAB9A | |
| SCHEMBL459184 | 0.68 | LMNA (0.50) | MKNK1MKNK2MPOHSP90AB1MAPT |
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-112876482-B | Polysubstituted heterocyclic derivative, preparation method and medical application thereof | 中国药科大学 | 2023-07-28 | — | — | CN | disclosed |
| CN-112876482-A | Polysubstituted heterocyclic derivative, preparation method and medical application thereof | 中国药科大学 | 2021-06-01 | — | — | CN | disclosed |