Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6685343 | 0.78 | EPHX1 (0.48) | EPHX1TRPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL11445194 | 0.77 | TDP1 (0.40) | EPHX1TRPA1ALDH1A1TSHRTAAR1 | |
| SCHEMBL28858512 | 0.76 | EPHX1 (0.46) | EPHX1TRPA1ALDH1A1TAAR1SLC6A2 | |
| SCHEMBL9171314 | 0.76 | TRPA1 (0.54) | EPHX1TRPA1TSHRTAAR1SLC6A2 | |
| SCHEMBL7472740 | 0.76 | TRPA1 (0.54) | EPHX1TRPA1TSHRTAAR1SLC6A2 | |
| SCHEMBL2241799 | 0.76 | TRPA1 (0.50) | EPHX1TRPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL10544290 | 0.76 | CYP1A2 (0.46) | EPHX1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL27697899 | 0.76 | EPHX1 (0.46) | EPHX1TRPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL4082647 | 0.76 | EPHX1 (0.41) | EPHX1TRPA1ALDH1A1TSHRTAAR1 | |
| SCHEMBL1278885 | 0.75 | EPHX1 (0.50) | EPHX1TRPA1ALDH1A1TSHRTAAR1 |
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-115197046-B | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-115197046-A | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2022-10-18 | — | — | CN | disclosed |