Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 2/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 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 | |
|---|---|---|---|---|
| SCHEMBL1822675 | 0.73 | KDM4E (0.43) | ANPEPKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL29481537 | 0.73 | KDM4E (0.43) | ANPEPKDM4EALDH1A1TSHRHSD17B10 | |
| Lithium SCHEMBL29773580 | 0.72 | KDM4E (0.42) | ANPEPKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL19100121 | 0.72 | ALDH1A1 (0.41) | ANPEPPAX8KDM4EALDH1A1TSHR | |
| SCHEMBL29714910 | 0.72 | ALDH1A1 (0.41) | ANPEPPAX8KDM4EALDH1A1TSHR | |
| SCHEMBL6987200 | 0.71 | DNMT1 (0.46) | ANPEPPAX8KDM4EALDH1A1TSHR | |
| SCHEMBL1505694 | 0.70 | ANPEP (0.41) | ANPEPPAX8ALDH1A1TSHRHSD17B10 | |
| SCHEMBL19055108 | 0.70 | ALDH1A1 (0.39) | ANPEPKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL23009261 | 0.70 | HPGD (0.47) | KDM4EALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL11790344 | 0.69 | DNMT1 (0.49) | PAX8ALDH1A1TSHRHSD17B10CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5106861-A | Method of using certain tetralin derivatives to produce analgesic relief | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-04-21 | — | — | US | claimed |