Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | WRN | Q14191 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MLNR | O43193 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8014766 | 1.00 | ALDH1A1 (0.37) | ALDH1A1GAAL3MBTL1LMNAPKM | |
| SCHEMBL7406895 | 0.90 | ALDH1A1 (0.40) | ALDH1A1GAAL3MBTL1TSHRWRN | |
| SCHEMBL6172742 | 0.89 | GAA (0.37) | ALDH1A1GAAL3MBTL1OPRM1GRIN2B | |
| SCHEMBL6702703 | 0.86 | MLNR (0.39) | ALDH1A1GAAL3MBTL1OPRD1PRKCA | |
| SCHEMBL5795799 | 0.86 | MLNR (0.39) | ALDH1A1GAAL3MBTL1OPRD1PRKCA | |
| SCHEMBL6296227 | 0.81 | GAA (0.39) | ALDH1A1GAAL3MBTL1LMNAGRIN2B | |
| SCHEMBL6297922 | 0.81 | GAA (0.39) | ALDH1A1GAAL3MBTL1LMNAGRIN2B | |
| SCHEMBL7890688 | 0.81 | NPC1 (0.38) | ALDH1A1GAAL3MBTL1OPRD1TSHR | |
| SCHEMBL8008763 | 0.77 | DRD2 (0.41) | OPRD1OPRM1OPRK1CHRM2DRD1 | |
| SCHEMBL7406212 | 0.77 | DAO (0.35) | ALDH1A1PKMOPRD1OPRM1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999014210-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED 5,6-DIHYDRO-2H-PYRAN-2-ONES | WARNER-LAMBERT COMPANY (US) | 1999-03-25 | — | — | WO | claimed |
| WO-1999014210-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED 5,6-DIHYDRO-2H-PYRAN-2-ONES | WARNER-LAMBERT COMPANY (US) | 1999-03-25 | — | — | WO | disclosed |