Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | GLS2 | Q9UI32 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 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 | |
|---|---|---|---|---|
| SCHEMBL5601594 | 0.98 | ACHE (0.39) | ACHEBACE1KCNH2HCAR2HCAR3 | |
| SCHEMBL5601985 | 0.94 | HCAR3 (0.33) | HCAR2HCAR3MAPTTDP1L3MBTL1 | |
| SCHEMBL5602018 | 0.79 | KCNH2 (0.35) | ACHEKCNH2HCAR2HCAR3PTGS2 | |
| SCHEMBL5600523 | 0.78 | KCNH2 (0.38) | ACHEKCNH2HCAR2PTGS2ALOX5 | |
| SCHEMBL5600793 | 0.78 | KCNH2 (0.38) | ACHEKCNH2HCAR2PTGS2ALOX5 | |
| SCHEMBL5600164 | 0.78 | KCNH2 (0.38) | ACHEKCNH2HCAR2PTGS2ALOX5 | |
| SCHEMBL5603255 | 0.78 | KCNH2 (0.38) | ACHEKCNH2HCAR2PTGS2ALOX5 | |
| SCHEMBL5601648 | 0.78 | KCNH2 (0.38) | ACHEKCNH2HCAR2PTGS2ALOX5 | |
| SCHEMBL16911240 | 0.74 | — | — | |
| SCHEMBL5603215 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | claimed |
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |