Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.35 |
| ▸ | CPA1 | P15085 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | CPB1 | P15086 | 1/20 | 0.33 |
| ▸ | CPA3 | P15088 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | ECE1 | P42892 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10731618 | 0.98 | EPHX1 (0.34) | EPHX1CPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL31152018 | 0.80 | SLC6A4 (0.42) | SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL15346933 | 0.80 | EPHX1 (0.41) | EPHX1CPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL9854300 | 0.78 | EPHX1 (0.34) | EPHX1CPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL31433296 | 0.77 | MTNR1A (0.39) | EPHX1CPA1SLC6A2SIGMAR1SLC6A4 | |
| SCHEMBL29173885 | 0.74 | CPA1 (0.35) | EPHX1CPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL10489340 | 0.74 | CYP1A2 (0.56) | CPA1CPB1CPA3CPB2CYP1A2 | |
| SCHEMBL28018404 | 0.72 | LMNA (0.33) | — | |
| SCHEMBL10737168 | 0.72 | EPHX1 (0.55) | EPHX1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL18918251 | 0.71 | HTR2A (0.37) | TAAR1SLC6A3CYP2D6 |
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-115710157-B | Fluorine-containing compound initiated by hindered free radical pair, and preparation method and application thereof | 吉林大学 | 2024-10-18 | — | — | CN | disclosed |
| EP-0252736-B1 | PROCESS FOR PREPARING FLUORINE-CONTAINING CARBOXYLIC ACID ESTER | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1991-07-24 | — | — | EP | disclosed |
| US-4855487-A | Process for preparing fluorine-containing carboxylic acid ester | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1989-08-08 | — | — | US | disclosed |
| EP-0252736-A2 | Process for preparing fluorine-containing carboxylic acid ester | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1988-01-13 | — | — | EP | disclosed |