Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29006220 | 1.00 | MAOA (0.48) | MAOAPTGS2LMNACA1CA2 | |
| SCHEMBL29006212 | 0.88 | MAOA (0.55) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006211 | 0.88 | MAOA (0.55) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006200 | 0.85 | MAOA (0.53) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006203 | 0.85 | MAOA (0.53) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006198 | 0.84 | MAOA (0.47) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006192 | 0.84 | MAOA (0.47) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006167 | 0.84 | MAOA (0.52) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006201 | 0.84 | MAOA (0.47) | MAOALMNACA1CA2CA4 | |
| SCHEMBL29006163 | 0.84 | MAOA (0.52) | MAOALMNACA1CA2CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116178232-A | Chiral hydroxy seleno ether and asymmetric synthesis method thereof | 湖北滋兰生物医药科技有限公司 | 2023-05-30 | — | — | CN | disclosed |