Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TK1 | P04183 | 4/20 | 0.41 |
| ▸ | PYGM | P11217 | 3/20 | 0.39 |
| ▸ | TK2 | O00142 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL5036896 | 1.00 | TK1 (0.41) | TK1PYGMTK2ALDH1A1LMNA | |
| SCHEMBL7619980 | 0.89 | TK2 (0.41) | TK1TK2ALB | |
| SCHEMBL29276434 | 0.89 | TK1 (0.50) | TK1POLB | |
| SCHEMBL7027956 | 0.89 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL5698865 | 0.89 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL29474410 | 0.89 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL7033423 | 0.89 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL29088052 | 0.87 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL29763091 | 0.87 | TK1 (0.39) | TK1ALDH1A1LMNAALBBLM | |
| SCHEMBL31051631 | 0.86 | TK1 (0.42) | TK1LMNAALBBLM |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996028170-A1 | REDUCED TOXICITY COMPOSITIONS AND METHODS FOR TREATING HIV INFECTIONS | YALE UNIVERSITY (US) | 1996-09-19 | — | — | WO | disclosed |