Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.73 |
| ▸ | TSHR | P16473 | 3/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.69 |
| ▸ | CA2 | P00918 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.62 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.62 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL108377 | 1.00 | ALDH1A1 (0.73) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL32670285 | 1.00 | ALDH1A1 (0.73) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL24300536 | 0.97 | ALDH1A1 (0.70) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL18969812 | 0.97 | ALDH1A1 (0.70) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL2532026 | 0.95 | ALDH1A1 (0.67) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL18350999 | 0.95 | TSHR (0.67) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| Isophthalic Acid SCHEMBL7186961 | 0.95 | ALDH1A1 (0.67) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL27826653 | 0.95 | ALDH1A1 (0.67) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL3777094 | 0.94 | PRSS1 (0.71) | ALDH1A1MAPK1TSHRCYP3A4CA2 | |
| SCHEMBL31655552 | 0.93 | ALDH1A1 (0.65) | ALDH1A1MAPK1TSHRCYP3A4CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024030746-A1 | RECYCLED CONTENT METAXYLENE AND RELATED CHEMICAL COMPOUNDS FROM WASTE PLASTIC | EASTMAN CHEMICAL COMPANY (US) | 2024-02-08 | — | — | WO | disclosed |