Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 11/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.49 |
| ▸ | CYP3A5 | P20815 | 7/20 | 0.49 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL9794534 | 0.96 | CYP19A1 (0.49) | CYP19A1CYP3A4CYP3A5KCNA5 | |
| SCHEMBL9373002 | 0.83 | CYP19A1 (0.41) | CYP19A1CYP3A4CYP3A5KCNA5 | |
| SCHEMBL10510419 | 0.74 | CYP19A1 (0.62) | CYP19A1CYP3A4CYP3A5 | |
| SCHEMBL10697743 | 0.74 | KCNA5 (0.58) | CYP19A1CYP3A4KCNA5 | |
| SCHEMBL9300288 | 0.73 | CYP19A1 (0.49) | CYP19A1CYP3A4CYP3A5 | |
| SCHEMBL11471496 | 0.73 | NPC1 (0.38) | CYP3A4 | |
| Hydrochloric Acid SCHEMBL10567073 | 0.72 | KCNA5 (0.56) | CYP19A1CYP3A4KCNA5 | |
| SCHEMBL17171925 | 0.72 | CYP19A1 (0.39) | CYP19A1CYP3A4CYP3A5 | |
| SCHEMBL9372057 | 0.71 | CYP19A1 (0.49) | CYP19A1CYP3A4CYP3A5KCNA5 | |
| SCHEMBL11140207 | 0.71 | CYP19A1 (0.58) | CYP19A1CYP3A4CYP3A5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0302366-B1 | Substituted pyridine derivatives | BAYER AG (DE) | 1994-09-14 | — | — | EP | disclosed |
| US-5047544-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-10 | — | — | US | disclosed |
| US-5036073-A | For agricultural use | BAYER AKTIENGESELLSCHAFT (DE) | 1991-07-30 | — | — | US | disclosed |
| EP-0302366-A2 | Substituted pyridine derivatives | BAYER AG (DE) | 1989-02-08 | — | — | EP | disclosed |
| EP-0302365-A2 | Substituted pyridines | BAYER AG (DE) | 1989-02-08 | — | — | EP | disclosed |