Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.35 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | UGT1A4 | P22310 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9369185 | 1.00 | CYP3A4 (0.44) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9365397 | 0.87 | CYP3A4 (0.45) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9365404 | 0.87 | CYP3A4 (0.45) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9369155 | 0.84 | FDPS (0.43) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9369161 | 0.84 | FDPS (0.43) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9644416 | 0.81 | CYP3A4 (0.45) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9644422 | 0.81 | CYP3A4 (0.45) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9643648 | 0.80 | CYP3A4 (0.47) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9788435 | 0.75 | FDPS (0.50) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A | |
| SCHEMBL9643270 | 0.74 | FDPS (0.40) | CYP3A4ALDH1A1FDPSHSP90AA1KMT2A |
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-5175169-A | Preservatives or plant safening agents | BAYER AKTIENGESELLSCHAFT (DE) | 1992-12-29 | — | — | US | disclosed |
| US-5081140-A | Fungicides, plant protection | BAYER AKTIENGESELLSCHAFT (DE) | 1992-01-14 | — | — | US | disclosed |