Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 9/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4200850 | 0.83 | TBXAS1 (0.55) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL610771 | 0.81 | ESR1 (0.50) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27939457 | 0.80 | TBXAS1 (0.64) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL333061 | 0.79 | TBXAS1 (0.78) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29403620 | 0.79 | TBXAS1 (0.78) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4424144 | 0.78 | GPR52 (0.59) | MAPT | |
| SCHEMBL4200852 | 0.78 | TBXAS1 (0.57) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL305976 | 0.77 | TBXAS1 (0.79) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL868044 | 0.77 | TBXAS1 (0.60) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL83186 | 0.77 | RECQL (0.62) | TBXAS1CYP1A2CYP3A4CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977105-A | Compounds | ASTRA PHARMAEUTICALS LTD. (GB) | 1999-11-02 | — | — | US | disclosed |
| CN-1208403-A | Compounds | BRITISH ASTRA PHARMACEUTICALS (GB) | 1999-02-17 | — | — | CN | disclosed |
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |