Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of 2-Allylphenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| 2-Allylphenol SCHEMBL325760 | 0.98 | POLB (0.54) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL17304230 | 0.96 | POLB (0.53) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL17304231 | 0.96 | POLB (0.53) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL27542206 | 0.92 | POLB (0.46) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL4936146 | 0.91 | POLB (0.49) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL28187371 | 0.91 | POLB (0.51) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL27502262 | 0.91 | POLB (0.45) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL27490025 | 0.90 | GABRA1 (0.55) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL28357989 | 0.90 | POLB (0.47) | POLBGABRA1GABRB2AKR1B1HSPA5 | |
| 2-Allylphenol SCHEMBL11073238 | 0.90 | POLB (0.47) | POLBGABRA1GABRB2AKR1B1HSPA5 |
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-101415327-B | Method of controlling phytopathogenic diseases on turfgrass | SYNGENTA PARTICIPATIONS AG | 2012-10-10 | — | — | CN | disclosed |
| CN-101415327-A | Method of controlling phytopathogenic diseases on turfgrass | SYNGENTA PARTICIPATIONS AG (CH) | 2009-04-22 | — | — | CN | disclosed |