Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | DDO | Q99489 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | CPT2 | P23786 | 1/20 | 0.35 |
| ▸ | CPT1A | P50416 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30516092 | 0.85 | MKNK2 (0.49) | MKNK1MKNK2HCAR2XDHKMO | |
| SCHEMBL30516103 | 0.81 | ATM (0.51) | KDM4EALDH1A1 | |
| SCHEMBL3181717 | 0.78 | MKNK1 (0.69) | MKNK1MKNK2HCAR2KDM4EALDH1A1 | |
| SCHEMBL941077 | 0.77 | KMO (0.53) | KDM4EALDH1A1POLBKMO | |
| SCHEMBL1319171 | 0.75 | MKNK1 (0.53) | MKNK1MKNK2HCAR2KDM4EALDH1A1 | |
| SCHEMBL15515155 | 0.75 | TP53 (0.46) | MKNK1MKNK2KDM4EALDH1A1 | |
| SCHEMBL29045118 | 0.75 | CCNC (0.48) | MKNK1MKNK2 | |
| SCHEMBL4760887 | 0.75 | PPARA (0.48) | MKNK1MKNK2KDM4EALDH1A1PPARA | |
| SCHEMBL30516056 | 0.73 | PPARA (0.40) | KMOPPARA | |
| SCHEMBL29045049 | 0.73 | PPARA (0.40) | KMOPPARA |
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-116514790-A | Tri-aromatic heterocyclic piperazine small molecular organic compound targeting STAT3 and application thereof | 华东师范大学 | 2023-08-01 | — | — | CN | disclosed |