Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 8/20 | 0.54 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | P2RY12 | Q9H244 | 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 | |
|---|---|---|---|---|
| SCHEMBL8969091 | 0.89 | ACHE (0.60) | ACHECTSDLMNACYP3A4PDE3B | |
| SCHEMBL8969632 | 0.88 | ACHE (0.40) | ACHELMNACYP3A4BCHEDRD4 | |
| SCHEMBL8969927 | 0.80 | ACHE (0.54) | ACHELMNACYP3A4PDE3BPDE3A | |
| SCHEMBL8969711 | 0.78 | ACHE (0.43) | ACHELMNACYP3A4CYP2D6BCHE | |
| SCHEMBL8968349 | 0.77 | ACHE (0.53) | ACHECTSDLMNACYP3A4PDE3B | |
| SCHEMBL8968804 | 0.76 | ACHE (0.62) | ACHECTSDLMNACYP3A4PDE3B | |
| SCHEMBL8969338 | 0.73 | ACHE (0.89) | ACHECTSDLMNACYP3A4PDE3B | |
| SCHEMBL8969241 | 0.72 | ACHE (0.97) | ACHECTSDLMNACYP3A4PDE3B | |
| SCHEMBL8968466 | 0.70 | ACHE (1.00) | ACHECTSDLMNACYP3A4BCHE | |
| SCHEMBL8968433 | 0.69 | ACHE (0.50) | ACHECTSDLMNACYP3A4PDE3B |
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-5486512-A | LEARNING ENHANCEMENT | WARNER-LAMBERT COMPANY (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1993003034-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |