Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 2/20 | 0.49 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | FPR1 | P21462 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11353036 | 0.98 | FDPS (0.48) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL14664121 | 0.83 | FDPS (0.50) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL17173877 | 0.82 | CYP1A2 (0.49) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL19483378 | 0.81 | FDPS (0.48) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL4178375 | 0.80 | MAPT (0.49) | CYP1A2CYP2C9KDM4EMAPTKMT2A | |
| SCHEMBL31754317 | 0.79 | TBXAS1 (0.47) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL24918847 | 0.78 | NLRP3 (0.46) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL22803234 | 0.78 | NLRP3 (0.46) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL8843832 | 0.78 | FDPS (0.43) | FDPSNAPRTTBXAS1CYP1A2CYP3A4 | |
| SCHEMBL8908045 | 0.75 | NLRP3 (0.48) | FDPSCYP1A2CYP3A4CYP2C9LMNA |
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-4262000-A | CONTAINING ETHER AND KETONE OR HYDROXYL GROUPS | BAYER AKTIENGESELLSCHAFT (DE) | 1981-04-14 | — | — | US | disclosed |
| EP-0016974-A1 | 3-Substituted pyridine derivatives, process for their preparation, their use as fungicides, and intermediates | BAYER AG (DE) | 1980-10-15 | — | — | EP | disclosed |