Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | MC5R | P33032 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6298407 | 1.00 | SIGMAR1 (0.58) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL8957574 | 0.92 | SIGMAR1 (0.54) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL2090154 | 0.91 | SIGMAR1 (0.50) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL14299363 | 0.91 | CYP1A2 (0.53) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL27873878 | 0.90 | CYP1A2 (0.51) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL5213383 | 0.89 | SIGMAR1 (0.51) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL29546077 | 0.88 | CYP1A2 (0.54) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL869422 | 0.88 | CYP1A2 (0.54) | SIGMAR1CYP1A2KDM4EMAPK1TDP1 | |
| SCHEMBL30746339 | 0.85 | SIGMAR1 (0.68) | SIGMAR1CYP1A2CYP2A6HDAC1HDAC8 | |
| SCHEMBL30418669 | 0.85 | SIGMAR1 (0.68) | SIGMAR1CYP1A2CYP2A6HDAC1HDAC8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115850002-A | Method for hydrodehalogenating halogenated alkane | 中国科学院兰州化学物理研究所 | 2023-03-28 | — | — | CN | disclosed |
| EP-1448571-B1 | HIGH REFRACTIVE INDEX AROMATIC-BASED SILOXANE MONOFUNCTIONAL MACROMONOMERS | BAUSCH & LOMB (US) | 2008-05-21 | — | — | EP | disclosed |
| US-7009023-B2 | Radiation transparent; lenses | BAUSCH & LOMB INCORPORATED (US) | 2006-03-07 | — | — | US | disclosed |