Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PRKCA | P17252 | 1/20 | 0.30 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.30 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.30 |
| ▸ | PRKCD | Q05655 | 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 | |
|---|---|---|---|---|
| SCHEMBL14848972 | 0.93 | ALDH1A1 (0.35) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL29017451 | 0.86 | ALDH1A1 (0.36) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL304955 | 0.86 | ALDH1A1 (0.36) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL15980581 | 0.84 | ALDH1A1 (0.33) | ALDH1A1USP2CNR1CNR2 | |
| Ethylene SCHEMBL23276997 | 0.82 | ALDH1A1 (0.33) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL25612632 | 0.81 | — | — | |
| SCHEMBL17213449 | 0.80 | USP2 (0.42) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL8522872 | 0.80 | ALDH1A1 (0.48) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL14848965 | 0.79 | THRB (0.33) | ALDH1A1USP2CNR1CNR2MAPT | |
| SCHEMBL12125098 | 0.78 | USP2 (0.46) | ALDH1A1USP2 |
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-9012241-B2 | Rapid detection and identification of energetic materials with surface enhanced raman spectrometry (SERS) | LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) | 2015-04-21 | — | — | US | disclosed |