Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | DGKA | P23743 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | PAM | P19021 | 2/20 | 0.50 |
| ▸ | MGAM | O43451 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | SI | P14410 | 1/20 | 0.50 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL127083 | 0.95 | — | — | |
| SCHEMBL11574119 | 0.93 | DGKA (0.65) | CYP1A2DGKAALDH1A1PAMTSHR | |
| Water SCHEMBL28265567 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| Fluoride SCHEMBL27898416 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| SCHEMBL28212348 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| SCHEMBL23295805 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| Hydrochloric Acid SCHEMBL27313358 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| Hexane SCHEMBL6159157 | 0.93 | DGKA (0.58) | CYP1A2DGKAALDH1A1PAMMGAM | |
| Hydrochloric Acid SCHEMBL27569028 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM | |
| SCHEMBL27760457 | 0.93 | CYP1A2 (0.64) | CYP1A2DGKAALDH1A1PAMMGAM |
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 |
|---|---|---|---|---|---|---|---|
| CN-118871423-A | Co-crystals or salts comprising xylometacin | 雷塞特制药股份有限公司 | 2024-10-29 | — | — | CN | disclosed |
| EP-0102503-A2 | Process for producing a catalyst component used for the polymerization of alpha-olefins | TOYO STAUFFER CHEMICAL CO. LTD. (JP) | 1984-03-14 | — | — | EP | disclosed |