Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29416020 | 0.75 | CYP2A6 (0.43) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL4592908 | 0.75 | CYP2A6 (0.43) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL29416023 | 0.72 | CYP2A6 (0.40) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL6831899 | 0.71 | ALDH1A1 (0.50) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL30184794 | 0.71 | ALDH1A1 (0.50) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL3951282 | 0.71 | ALDH1A1 (0.39) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL988672 | 0.71 | POLB (0.37) | ALDH1A1TDP1TSHRHPGD | |
| SCHEMBL711370 | 0.68 | ALDH1A1 (0.42) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL2686125 | 0.67 | CYP1A2 (0.48) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 | |
| SCHEMBL4582431 | 0.67 | ALDH1A1 (0.48) | ALDH1A1CYP2A6TDP1TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0117228-A1 | Analogs of mevalonolactone and derivatives thereof, processes for their production, pharmaceutical compositions containing them and their use as pharmaceuticals | SANDOZ AG (CH) | 1984-08-29 | — | — | EP | disclosed |
| EP-0114027-A1 | Analogs of mevalolactone and derivatives thereof, processes for their production, pharmaceutical compositions containing them and their use as pharmaceuticals | SANDOZ AG (CH) | 1984-07-25 | — | — | EP | disclosed |