Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28426007 | 1.00 | SLC6A2 (0.41) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL27761276 | 0.86 | ALDH1A1 (0.45) | SLC6A2SLC6A4ALDH1A1GLATSHR | |
| SCHEMBL28130586 | 0.82 | SLC6A2 (0.51) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL5596590 | 0.81 | CYP2C19 (0.39) | CYP2C19ALDH1A1GLATSHRKMT2A | |
| SCHEMBL5596586 | 0.81 | CYP2C19 (0.39) | CYP2C19ALDH1A1GLATSHRKMT2A | |
| SCHEMBL679865 | 0.80 | ALDH1A1 (0.41) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL430660 | 0.80 | ALDH1A1 (0.46) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL4564576 | 0.80 | ALDH1A1 (0.41) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL430659 | 0.80 | ALDH1A1 (0.46) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA | |
| SCHEMBL27820012 | 0.80 | ALDH1A1 (0.41) | SLC6A2SLC6A4CYP2C19ALDH1A1GLA |
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-111051329-A | Hamiltrin derivatives and antibody drug complexes thereof | 大日本住友制药株式会社 | 2020-04-21 | — | — | CN | disclosed |