Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.36 |
| ▸ | CFB | P00751 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | TNKS2 | Q9H2K2 | 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 | |
|---|---|---|---|---|
| SCHEMBL30819522 | 0.79 | CYP2B6 (0.42) | CYP2B6CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL6247638 | 0.79 | CYP2B6 (0.42) | CYP2B6CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL6167710 | 0.79 | CYP1A2 (0.46) | CYP2B6CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL9112587 | 0.79 | CYP2B6 (0.39) | CYP2B6CYP1A2CYP1A1MAOA | |
| SCHEMBL9112001 | 0.73 | HTT (0.47) | CYP2B6CYP1A2CYP1A1 | |
| SCHEMBL29372595 | 0.71 | CYP2B6 (0.43) | CYP2B6CYP1A2CYP1A1CYP1B1CYP2A6 | |
| SCHEMBL1043402 | 0.71 | CYP2B6 (0.43) | CYP2B6CYP1A2CYP1A1CYP1B1CYP2A6 | |
| SCHEMBL29365059 | 0.71 | CYP2B6 (0.43) | CYP2B6CYP1A2CYP1A1CYP1B1CYP2A6 | |
| SCHEMBL3708936 | 0.71 | HPRT1 (0.47) | CYP2B6CYP1A2CYP1A1CYP1B1CYP2A6 | |
| SCHEMBL12043463 | 0.71 | CYP2B6 (0.42) | CYP2B6CYP1A2CYP1A1CYP1B1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995016215-A1 | NOVEL SUBSTITUTED NAPHTHOPYRANS | PPG INDUSTRIES, INC. (US) | 1995-06-15 | — | — | WO | claimed |