Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL5540169 | 0.75 | CYP2D6 (0.36) | CYP2D6MEN1RECQLKMT2ACTSD | |
| SCHEMBL7422185 | 0.75 | BRD4 (0.38) | CYP2D6MEN1RECQLKMT2ACTSD | |
| SCHEMBL7422184 | 0.75 | BRD4 (0.38) | CYP2D6MEN1RECQLKMT2ACTSD | |
| SCHEMBL1451031 | 0.75 | CYP2D6 (0.43) | CYP2D6MEN1RECQLKMT2ACTSD | |
| SCHEMBL31490422 | 0.71 | IDO1 (0.46) | IDO1 | |
| SCHEMBL1923692 | 0.71 | IDO1 (0.46) | IDO1 | |
| SCHEMBL6802213 | 0.70 | CYP2D6 (0.38) | CYP2D6MEN1RECQLKMT2ACTSD | |
| SCHEMBL5544337 | 0.65 | NOS1 (0.33) | NOS3NOS1NOS2 | |
| SCHEMBL3523540 | 0.64 | — | — | |
| SCHEMBL1243147 | 0.62 | PLAU (0.56) | — |
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-4971957-A | ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS, BENZENECARBOXAMIDOPHOSPHONATES OR BENZENETHIOCARBOXAMIDOPHOSPHONATES | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1990-11-20 | — | — | US | disclosed |