Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8668680 | 0.99 | FYN (0.39) | FYNMAPTALDH1A1CYP3A4PKM | |
| SCHEMBL8669857 | 0.78 | ALDH1A1 (0.39) | FYNMAPTALDH1A1CYP3A4CTSB | |
| SCHEMBL8669853 | 0.78 | ALDH1A1 (0.39) | FYNMAPTALDH1A1CYP3A4CTSB | |
| SCHEMBL8671076 | 0.78 | ALDH1A1 (0.39) | FYNMAPTALDH1A1CYP3A4CTSB | |
| Hydrochloric Acid SCHEMBL8668055 | 0.77 | ALDH1A1 (0.38) | FYNMAPTALDH1A1CYP3A4CTSB | |
| SCHEMBL8669254 | 0.74 | THRA (0.38) | ALDH1A1CYP3A4CYP1A2CTSBLMNA | |
| SCHEMBL21962340 | 0.72 | GRIN1 (0.48) | MAPTALDH1A1CYP3A4CTSB | |
| SCHEMBL8668636 | 0.70 | CA1 (0.44) | ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL8671380 | 0.70 | MAPT (0.38) | MAPTALDH1A1CYP3A4PKMMEN1 | |
| SCHEMBL8702721 | 0.69 | ALDH1A1 (0.32) | ALDH1A1CYP3A4 |
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-5721234-A | TREATING CONVULSIONS, ANXIETY, CEREBRAL HYPOXIA/ISCHEMIA, PARKINSON*S DISEASE | WARNER-LAMBERT COMPANY (US) | 1998-02-24 | — | — | US | disclosed |
| WO-1996017832-A1 | NOVEL GLUTAMATE RECEPTOR ANTAGONISTS: FUSED CYCLOALKYLQUINOXALINEDIONES | WARNER-LAMBERT COMPANY (US) | 1996-06-13 | — | — | WO | disclosed |