Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 7/20 | 0.48 |
| ▸ | MME | P08473 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | XIAP | P98170 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5619200 | 0.83 | REN (0.53) | CYP2D6CYP1A2ACEMMEALPI | |
| SCHEMBL638421 | 0.82 | CYP1A2 (0.52) | TRPA1TBXAS1CYP1A2ACEMME | |
| SCHEMBL10127215 | 0.82 | TRPA1 (0.69) | TRPA1CYP2D6ACEMMENPC1 | |
| SCHEMBL14946403 | 0.82 | TRPA1 (0.63) | TRPA1CYP2D6CYP1A2ACENPC1 | |
| SCHEMBL8289807 | 0.82 | TRPA1 (0.63) | TRPA1CYP2D6CYP1A2ACENPC1 | |
| SCHEMBL11210664 | 0.80 | CYP1A2 (0.53) | TBXAS1CYP1A2ACEMMENPC1 | |
| SCHEMBL17171335 | 0.80 | CYP1A2 (0.53) | TBXAS1CYP1A2ACEMMENPC1 | |
| SCHEMBL17171334 | 0.80 | CYP1A2 (0.53) | TBXAS1CYP1A2ACEMMENPC1 | |
| SCHEMBL65930 | 0.79 | CYP1A2 (0.61) | TBXAS1CYP1A2NPC1RAB9AALPI | |
| SCHEMBL265577 | 0.79 | CYP1A2 (0.61) | TBXAS1CYP1A2NPC1RAB9AALPI |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010024772-A1 | ASPARTYL PROTEASE INHIBITORS | MEDIVIR AB (SE) | 2010-03-04 | — | — | WO | disclosed |
| WO-2008107365-A1 | NEW COMPOUNDS | MEDIVIR AB (SE) | 2008-09-12 | — | — | WO | disclosed |