Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RNF4 | P78317 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2853674 | 0.93 | LTB4R2 (0.37) | LTB4R2ALDH1A1KMT2AMEN1LMNA | |
| SCHEMBL2850998 | 0.92 | LTB4R2 (0.37) | LTB4R2ALDH1A1KMT2AMEN1LMNA | |
| SCHEMBL2861742 | 0.92 | SLC6A4 (0.37) | LTB4R2ALDH1A1PTGDR2SLC6A4 | |
| SCHEMBL2861774 | 0.91 | GAA (0.38) | LTB4R2KMT2AMEN1LMNASLC6A4 | |
| SCHEMBL13711758 | 0.88 | SLC6A4 (0.41) | LTB4R2ALDH1A1SLC6A4 | |
| SCHEMBL2851580 | 0.87 | STAT3 (0.36) | OPRM1ALDH1A1KMT2AMEN1MAPK1 | |
| SCHEMBL4457062 | 0.86 | SLC6A4 (0.35) | LTB4R2ALDH1A1PTGDR2SLC6A4 | |
| SCHEMBL13711662 | 0.86 | SLC6A4 (0.41) | LTB4R2SLC6A4 | |
| SCHEMBL13711754 | 0.86 | LTB4R2 (0.43) | LTB4R2SLC6A4 | |
| SCHEMBL2861740 | 0.85 | SLC6A4 (0.34) | LTB4R2OPRM1ALDH1A1KMT2AMEN1 |
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-1654247-B1 | ALKYNYL ARYL CARBOXAMIDES | MERCK SERONO SA (CH) | 2010-01-20 | — | — | EP | disclosed |