Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8478210 | 0.85 | PTGS2 (0.50) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL6168789 | 0.85 | CA2 (0.54) | PTGS2CA12CA1CA2CA9 | |
| SCHEMBL4059081 | 0.82 | CYP1A2 (0.57) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL5139807 | 0.73 | MAPT (0.46) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL4799697 | 0.72 | CYP1A2 (0.53) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL390107 | 0.72 | CYP1A2 (0.49) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL27493990 | 0.72 | CYP1A2 (0.49) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL3874275 | 0.72 | CYP1A2 (0.49) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL20507219 | 0.72 | CYP1A2 (0.49) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 | |
| SCHEMBL27683230 | 0.72 | CYP1A2 (0.49) | CYP2C9CYP1A2CYP2D6CYP19A1CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116669551-A | Agrochemical compositions with improved drift, absorption and rain resistance | 拜耳公司 | 2023-08-29 | — | — | CN | disclosed |