Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23354885 | 0.81 | ADRB2 (0.39) | ADRB2ADRB1ADRB3 | |
| SCHEMBL29873480 | 0.78 | PCSK9 (0.41) | ADRB2ADRB1ADRB3CYP3A4 | |
| SCHEMBL9178986 | 0.77 | KDM4E (0.39) | CA2 | |
| SCHEMBL23354701 | 0.77 | CA2 (0.35) | ADRB2ADRB1ADRB3CYP3A4CYP2C19 | |
| SCHEMBL1677942 | 0.75 | CA2 (0.39) | CYP3A4CYP2C19CA2 | |
| SCHEMBL23354728 | 0.71 | CNR1 (0.36) | CYP3A4CA2 | |
| SCHEMBL5572477 | 0.71 | CA2 (0.32) | CA2 | |
| SCHEMBL9563493 | 0.70 | TAAR1 (0.43) | CYP3A4CYP2C19 | |
| SCHEMBL9563491 | 0.70 | TAAR1 (0.43) | CYP3A4CYP2C19 | |
| SCHEMBL9602856 | 0.70 | CYP3A4 (0.36) | CYP3A4CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023126006-A1 | CATIONIC LIPID CONTAINING FUNCTIONAL GROUP ON SIDE CHAIN, AND USE THEREOF | 厦门赛诺邦格生物科技股份有限公司 | 2023-07-06 | — | — | WO | disclosed |