Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29367659 | 1.00 | CYP3A4 (0.45) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL15822013 | 1.00 | CYP3A4 (0.45) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL17289535 | 1.00 | CYP3A4 (0.45) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL14645417 | 1.00 | CYP3A4 (0.45) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL15961536 | 0.94 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL17223573 | 0.92 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL15572502 | 0.92 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL29367541 | 0.92 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL15825100 | 0.92 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 | |
| SCHEMBL20337001 | 0.91 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19CYP19A1HSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116568134-A | Tank mix adjuvant formulation with low drift, rain resistance, high spreadability, high absorption and ULV | 拜耳公司 | 2023-08-08 | — | — | CN | disclosed |
| CN-111225565-B | Aqueous suspension concentrates | FMC公司 | 2023-01-31 | — | — | CN | disclosed |