Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | OGG1 | O15527 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.32 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL440244 | 1.00 | CYP2A6 (0.57) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL2700861 | 0.91 | ALDH1A1 (0.52) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL3956177 | 0.88 | ALDH1A1 (0.53) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL3083376 | 0.88 | ALDH1A1 (0.53) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL17941356 | 0.88 | ALDH1A1 (0.53) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL3079657 | 0.86 | CYP2A6 (0.42) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL13149684 | 0.86 | MEN1 (0.42) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL13149673 | 0.86 | ALOX15 (0.68) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL452831 | 0.86 | ALDH1A1 (0.68) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL3092338 | 0.86 | CYP2A6 (0.42) | CYP2A6CA2CA1CA5ACA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112724373-B | Functional organic porous polymer and preparation method and application thereof | 山东大学 | 2021-09-21 | — | — | CN | claimed |
| CN-112724373-A | Functional organic porous polymer and preparation method and application thereof | 山东大学 | 2021-04-30 | — | — | CN | claimed |
| CN-112724373-B | Functional organic porous polymer and preparation method and application thereof | 山东大学 | 2021-09-21 | — | — | CN | disclosed |
| CN-112724373-A | Functional organic porous polymer and preparation method and application thereof | 山东大学 | 2021-04-30 | — | — | CN | disclosed |