Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.55 |
| ▸ | HRH1 | P35367 | 2/20 | 0.53 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30758759 | 0.98 | — | — | |
| SCHEMBL177933 | 0.98 | — | — | |
| Oxalic Acid SCHEMBL27256580 | 0.88 | TBXAS1 (0.60) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| Phosphonic Acid SCHEMBL9074693 | 0.88 | CHRNA7 (0.53) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| Acetic Acid SCHEMBL9370978 | 0.87 | TBXAS1 (0.58) | CHRNA7CYP2A6TDP1L3MBTL1TBXAS1 | |
| SCHEMBL294520 | 0.85 | CYP2A6 (0.66) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| SCHEMBL10660432 | 0.84 | TBXAS1 (0.66) | CHRNA7TDP1HRH4HRH3TBXAS1 | |
| SCHEMBL724866 | 0.84 | CHRNA7 (0.74) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| SCHEMBL29485692 | 0.84 | CHRNA7 (0.74) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 | |
| SCHEMBL1288240 | 0.83 | TDP1 (0.67) | CHRNA7CYP2A6TDP1L3MBTL1HRH4 |
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-5891863-A | PREVENT RESORPTION OF PROSTHETIC BONE | MERCK & CO., INC. (US) | 1999-04-06 | — | — | US | disclosed |