Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | F2RL1 | P55085 | 3/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | LDHB | P07195 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL29240397 | 0.80 | TRPA1 (0.50) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL23268913 | 0.75 | SRC (0.44) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL11918179 | 0.72 | TDP1 (0.44) | TAAR1TRPA1LMNACHRM1SLC6A2 | |
| SCHEMBL8239632 | 0.71 | ALDH1A1 (0.50) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Hydrogen Peroxide SCHEMBL11334349 | 0.71 | LDHA (0.42) | TAAR1SRCAMY1ALDHALDHB | |
| SCHEMBL8238610 | 0.71 | LMNA (0.63) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL414579 | 0.71 | TDP1 (0.50) | TAAR1SLC6A2NOS3NOS1NOS2 | |
| SCHEMBL224199 | 0.71 | AMY1A (0.57) | TAAR1TRPA1LMNAAMY1ACNR1 | |
| SCHEMBL2045305 | 0.70 | TAAR1 (0.65) | TAAR1AMY1AKMT2AALDH1A1GAA | |
| SCHEMBL10822849 | 0.70 | TAAR1 (0.43) | TAAR1SRCAMY1ALDHALDHB |
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-3625228-B1 | PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS | IDORSIA PHARMACEUTICALS LTD (CH) | 2021-07-07 | — | — | EP | disclosed |