Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9348125 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL20002894 | 0.71 | — | — | |
| SCHEMBL9343508 | 0.66 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL9344541 | 0.65 | CETP (0.35) | CETP | |
| SCHEMBL23166662 | 0.63 | GRN (0.42) | ALDH1A1 | |
| SCHEMBL5711380 | 0.63 | MBTPS1 (0.50) | MBTPS1ALDH1A1 | |
| SCHEMBL16445120 | 0.62 | MBTPS1 (0.43) | MBTPS1ALDH1A1 | |
| SCHEMBL16445117 | 0.62 | MBTPS1 (0.43) | MBTPS1ALDH1A1 | |
| SCHEMBL24263339 | 0.62 | CTSK (0.35) | MBTPS1ALDH1A1 | |
| SCHEMBL24350248 | 0.62 | CTSK (0.35) | MBTPS1ALDH1A1 |
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-5362477-A | 19F magnetic resonance imaging agents which include a nitroxide moiety | MALLINCKRODT MEDICAL, INC. (US) | 1994-11-08 | — | — | US | disclosed |