Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1681776 | 1.00 | LMNA (0.31) | LMNATSHRMEN1ALDH1A1CYP3A4 | |
| SCHEMBL29070637 | 0.85 | — | — | |
| SCHEMBL30198804 | 0.74 | MEN1 (0.33) | MEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL10738039 | 0.74 | MEN1 (0.36) | MEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL2543405 | 0.74 | MEN1 (0.36) | MEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL4959097 | 0.73 | — | — | |
| SCHEMBL9053292 | 0.68 | MEN1 (0.32) | MEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL9052184 | 0.68 | MEN1 (0.32) | MEN1ALDH1A1CYP3A4KMT2A | |
| SCHEMBL368962 | 0.67 | — | — | |
| SCHEMBL15533578 | 0.67 | MEN1 (0.30) | MEN1ALDH1A1CYP3A4KMT2A |
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-20030203460-A1 | Biocatalytic synthesis of quinic acid and conversion to hydroquinone | NATIONAL SCIENCE FOUNDATION | 2003-10-30 | — | — | US | disclosed |