Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | PTGES | O14684 | 2/20 | 0.54 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.54 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.54 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.54 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.54 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.54 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9554565 | 0.85 | PTPN1 (0.61) | ALDH1A1PTGESL3MBTL1 | |
| SCHEMBL22634292 | 0.84 | ATM (0.55) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL22634288 | 0.84 | ATM (0.55) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL7806984 | 0.80 | ATM (0.68) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL1884230 | 0.80 | ATM (0.68) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL1879654 | 0.80 | ATM (0.68) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL803579 | 0.80 | ATM (0.68) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL6295802 | 0.80 | ATM (0.68) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL11015260 | 0.80 | ATM (0.60) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL22647465 | 0.79 | ATM (0.50) | ATMALDH1A1THRBCYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5250517-A | Hypotensive and cardiotonic agents; cardiac insufficiency | HOFFMANN-LA ROCHE INC. (US) | 1993-10-05 | — | — | US | disclosed |
| EP-0386611-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1990-09-12 | — | — | EP | disclosed |
| EP-0310918-A2 | Peptide-like amino-acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1989-04-12 | — | — | EP | disclosed |