Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.58 |
| ▸ | SLC18A3 | Q16572 | 8/20 | 0.53 |
| ▸ | LIPE | Q05469 | 1/20 | 0.49 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7274837 | 0.94 | KMO (0.55) | KMOSLC18A3TRPA1AKR1C3AKR1C1 | |
| Bicarbonate SCHEMBL9436080 | 0.91 | KMO (0.61) | KMOSLC18A3HAO1AKR1C3AKR1C1 | |
| Bicarbonate SCHEMBL4410582 | 0.91 | KMO (0.61) | KMOSLC18A3HAO1AKR1C3AKR1C1 | |
| Bicarbonate SCHEMBL4407651 | 0.91 | KMO (0.61) | KMOSLC18A3HAO1AKR1C3AKR1C1 | |
| Methyl Alcohol SCHEMBL27426390 | 0.89 | SLC18A3 (0.57) | KMOSLC18A3TRPA1CYP2D6SMN1; SMN2 | |
| Bicarbonate SCHEMBL4412934 | 0.89 | KMO (0.58) | KMOSLC18A3HAO1TRPA1AKR1C3 | |
| Hydrogen Peroxide SCHEMBL9997756 | 0.89 | SLC18A3 (0.61) | KMOSLC18A3TRPA1CYP2D6SMN1; SMN2 | |
| Hydrogen Peroxide SCHEMBL5901852 | 0.89 | SLC18A3 (0.61) | KMOSLC18A3TRPA1CYP2D6SMN1; SMN2 | |
| Hydrogen Peroxide SCHEMBL11586135 | 0.89 | SLC18A3 (0.61) | KMOSLC18A3TRPA1CYP2D6SMN1; SMN2 | |
| Hydrogen Peroxide SCHEMBL42934 | 0.89 | SLC18A3 (0.61) | KMOSLC18A3TRPA1CYP2D6SMN1; SMN2 |
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-108329243-A | Polymer/metallic porphyrin and n-Hydroxyphthalimide concerted catalysis cyclohexylbenzene hydroperoxide | 湖南大学 | 2018-07-27 | — | — | CN | disclosed |
| CN-106316913-A | Process and reactor system for oxidizing cycloalkylbenzene | 埃克森美孚化学专利公司 | 2017-01-11 | — | — | CN | disclosed |