Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | L3MBTL3 | Q96JM7 | 2/20 | 0.46 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27551305 | 0.86 | SIGMAR1 (0.50) | SLC6A3SIGMAR1HRH3CYP1A2HTR1A | |
| SCHEMBL5395459 | 0.85 | SIGMAR1 (0.53) | SLC6A3SIGMAR1L3MBTL3HTR1ADRD2 | |
| SCHEMBL6292101 | 0.85 | SIGMAR1 (0.57) | SLC6A3SIGMAR1HRH3DRD2 | |
| SCHEMBL23113743 | 0.81 | HRH3 (0.47) | SIGMAR1HRH3TDP1 | |
| SCHEMBL28668660 | 0.81 | DRD2 (0.71) | SIGMAR1HTR1ADRD2 | |
| SCHEMBL845155 | 0.78 | HRH3 (0.52) | SLC6A3SIGMAR1HRH3L3MBTL1L3MBTL3 | |
| SCHEMBL6293319 | 0.77 | SIGMAR1 (0.59) | SIGMAR1 | |
| SCHEMBL4002161 | 0.77 | ALDH1A1 (0.45) | L3MBTL1 | |
| SCHEMBL9597186 | 0.77 | SLC6A3 (0.91) | SLC6A3SIGMAR1HRH3L3MBTL1L3MBTL3 | |
| SCHEMBL161004 | 0.76 | HRH3 (0.55) | SIGMAR1HRH3TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103664993-B | Compound of one class treatment ischemic brain damage and uses thereof | HAN BING (CN) | 2016-05-25 | — | — | CN | claimed |
| CN-103664993-B | Compound of one class treatment ischemic brain damage and uses thereof | HAN BING (CN) | 2016-05-25 | — | — | CN | disclosed |