Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1326003 | 0.81 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL1327031 | 0.81 | CYP3A4 (0.44) | ALDH1A1 | |
| SCHEMBL1327423 | 0.81 | TTR (0.31) | — | |
| SCHEMBL135026 | 0.77 | — | — | |
| SCHEMBL1326460 | 0.77 | CYP1A1 (0.48) | ALDH1A1 | |
| SCHEMBL11547231 | 0.74 | MAPT (0.48) | ALDH1A1 | |
| SCHEMBL21881930 | 0.74 | AKT2 (0.43) | ALDH1A1 | |
| SCHEMBL18266944 | 0.74 | CCR1 (0.32) | CYP2A6ALDH1A1FKBP5 | |
| SCHEMBL6739910 | 0.72 | — | — | |
| SCHEMBL1553320 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050084446-A1 | Zeolite synthesis with directing agents with approximately perpendicular groups | SCHMITT KIRK D (US) | 2005-04-21 | — | — | US | claimed |
| US-20050084446-A1 | Zeolite synthesis with directing agents with approximately perpendicular groups | SCHMITT KIRK D (US) | 2005-04-21 | — | — | US | disclosed |