Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | MTHFD2 | P13995 | 5/20 | 0.48 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | TACR3 | P29371 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11090495 | 0.84 | PTGS1 (0.47) | PTGS1MTHFD2PTGDR2CYP2C9CFTR | |
| SCHEMBL11092323 | 0.81 | CDK1 (0.50) | PTGS1MTHFD2PTGDR2CYP2C9 | |
| SCHEMBL11400880 | 0.80 | PTGS1 (0.50) | PTGS1MTHFD2PTGDR2CYP2C9GRM5 | |
| SCHEMBL11397662 | 0.77 | PTGS1 (0.58) | PTGS1MTHFD2PTGDR2CYP2C9GRM5 | |
| SCHEMBL11088651 | 0.74 | PTGS1 (0.68) | PTGS1GRM5HPGD | |
| SCHEMBL8240452 | 0.72 | TSHR (0.49) | MTHFD2PTGDR2CYP2C9GRM5HPGD | |
| SCHEMBL12320789 | 0.71 | KCNK3 (0.60) | MTHFD2TACR3HPGD | |
| SCHEMBL14591322 | 0.70 | PTGDR2 (0.58) | MTHFD2PTGDR2CYP2C9KIF11HPGD | |
| SCHEMBL12680944 | 0.69 | GRM5 (0.60) | MTHFD2GRM5 | |
| SCHEMBL11085211 | 0.69 | PTGS1 (0.68) | PTGS1GRM5HPGD |
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-4478837-A | HYPOTENSIVE AGENTS | SANDOZ LTD. (CH) | 1984-10-23 | — | — | US | disclosed |
| US-3954754-A | ANTIHYPERTENSIVES | SANDOZ LTD. (CH) | 1976-05-04 | — | — | US | disclosed |