Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | SLC7A5 | Q01650 | 4/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | ALPI | P09923 | 1/20 | 0.42 |
| ▸ | XIAP | P98170 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21639441 | 1.00 | CYP1A2 (0.53) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL25657792 | 0.74 | HSD17B10 (0.53) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL21643057 | 0.73 | CYP1A2 (0.38) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL21643055 | 0.73 | CYP1A2 (0.38) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL7405225 | 0.70 | HSD17B10 (0.51) | SLC7A5PKMPTGS1ALPIXIAP | |
| SCHEMBL7405224 | 0.70 | HSD17B10 (0.51) | SLC7A5PKMPTGS1ALPIXIAP | |
| SCHEMBL5326873 | 0.69 | CYP1A2 (1.00) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL4170158 | 0.67 | CYP1A2 (0.50) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL13957336 | 0.67 | CYP1A2 (0.50) | CYP1A2SLC7A5PKMPTGS1ALPI | |
| SCHEMBL43593 | 0.67 | SLC7A5 (0.62) | CYP1A2SLC7A5PKMPTGS1ALPI |
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-3604326-A1 | PEPTIDE COMPOUND AND METHOD FOR PRODUCING SAME, COMPOSITION FOR SCREENING USE, AND METHOD FOR SELECTING PEPTIDE COMPOUND | FUJIFILM Corporation (JP) | 2020-02-05 | — | — | EP | disclosed |