Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT5 | O14744 | 3/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28739006 | 0.89 | KMT2A (0.45) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL29644435 | 0.89 | KMT2A (0.45) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL28739132 | 0.81 | KEAP1 (0.44) | KMT2ALMNAHPGDFFAR1ALDH1A1 | |
| SCHEMBL29644302 | 0.81 | KEAP1 (0.44) | KMT2ALMNAHPGDFFAR1ALDH1A1 | |
| SCHEMBL29644336 | 0.79 | FFAR1 (0.50) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL28739159 | 0.79 | FFAR1 (0.50) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL28739120 | 0.76 | FFAR1 (0.48) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL29644442 | 0.76 | FFAR1 (0.48) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL28739082 | 0.76 | FFAR1 (0.51) | PRMT5WDR77KMT2ALMNAMAPT | |
| SCHEMBL29644457 | 0.76 | FFAR1 (0.51) | PRMT5WDR77KMT2ALMNAMAPT |
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-114507181-B | Propionic acid compound containing 5-substituted tetrahydroisoquinoline, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2024-03-26 | — | — | CN | disclosed |