Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | PNMT | P11086 | 2/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29802201 | 0.98 | CYP3A4 (0.44) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL29655581 | 0.98 | CYP3A4 (0.44) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL29518446 | 0.84 | CYP3A4 (0.52) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL9854456 | 0.84 | CYP3A4 (0.52) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL1768303 | 0.83 | CYP3A4 (0.46) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL29996019 | 0.82 | CYP3A4 (0.50) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL29672644 | 0.82 | CYP3A4 (0.50) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL31158056 | 0.82 | CYP3A4 (0.50) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL10596637 | 0.80 | CYP3A4 (0.48) | CYP3A4TDP1DRD1TSHRLMNA | |
| SCHEMBL31258429 | 0.80 | CYP3A4 (0.48) | CYP3A4TDP1DRD1TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4157814-A1 | SYNTHESIS OF PHEROMONE DERIVATIVES VIA Z-SELECTIVE OLEFIN METATHESIS | Provivi, Inc. (US) | 2023-04-05 | — | — | EP | disclosed |