Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 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 | |
|---|---|---|---|---|
| SCHEMBL17064435 | 1.00 | SLC6A3 (0.39) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL133373 | 0.80 | SLC6A2 (0.46) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL7677713 | 0.79 | SLC6A3 (0.39) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL17064838 | 0.78 | SLC6A2 (0.47) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL31067503 | 0.78 | SLC6A2 (0.47) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL23610045 | 0.77 | SLC6A3 (0.46) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL17064619 | 0.77 | CA1 (0.41) | SLC6A3SLC6A2SLC6A4KCNH2CYP3A4 | |
| SCHEMBL5655372 | 0.77 | SLC6A3 (0.46) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL5655181 | 0.77 | SLC6A3 (0.46) | SLC6A3SLC6A2SLC6A4MAPTBRD4 | |
| SCHEMBL17842469 | 0.77 | SLC6A3 (0.46) | SLC6A3SLC6A2SLC6A4MAPTBRD4 |
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-113307772-B | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2024-06-28 | — | — | CN | disclosed |