Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | AHR | P35869 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 3/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL1304745 | 1.00 | CYP2A6 (0.37) | CYP2A6AHRALOX15NR4A2ALDH1A1 | |
| SCHEMBL1539492 | 0.81 | HSP90AA1 (0.42) | CYP2A6AHRALOX15NR4A2ALDH1A1 | |
| SCHEMBL1569950 | 0.77 | MAPK1 (0.36) | CYP2A6AHRNR4A2ALDH1A1MAPK1 | |
| SCHEMBL15056090 | 0.77 | DGAT1 (0.36) | CYP2A6AHRALOX15NR4A2ALDH1A1 | |
| SCHEMBL3872105 | 0.77 | APLNR (0.44) | CYP2A6AHRNR4A2ALDH1A1KMT2A | |
| SCHEMBL24416900 | 0.77 | MAOB (0.39) | CYP2A6AHRNR4A2ALDH1A1MAPK1 | |
| SCHEMBL1539565 | 0.74 | GPR84 (0.33) | ALDH1A1 | |
| SCHEMBL1683312 | 0.74 | GPR84 (0.33) | CSNK2A1GABRA1GABRB1 | |
| SCHEMBL396064 | 0.74 | MAOB (0.44) | CYP2A6AHRNR4A2NOS1MCL1 | |
| SCHEMBL2061830 | 0.72 | GAA (0.41) | ALOX15ALDH1A1MAPK1TDP1L3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4448504-A1 | NAPHTHALENE AND QUINOLINE ANALOGS AS RXFP1 AGONISTS | Bristol-Myers Squibb Company (US) | 2024-10-23 | — | — | EP | disclosed |
| CN-118414330-A | Naphthalene and quinoline analogs as RXFP1 agonists | 百时美施贵宝公司 | 2024-07-30 | — | — | CN | disclosed |
| WO-2023114818-A1 | NAPHTHALENE AND QUINOLINE ANALOGS AS RXFP1 AGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2023-06-22 | — | — | WO | disclosed |
| CN-114560885-B | Sound-sensitive agent with low phototoxicity and preparation method and application thereof | 北京理工大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-114560885-A | Sound-sensitive agent with low phototoxicity and preparation method and application thereof | 北京理工大学 | 2022-05-31 | — | — | CN | disclosed |