Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 7/20 | 0.60 |
| ▸ | HTR6 | P50406 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.48 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3929012 | 0.81 | CYP1A2 (0.61) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24388658 | 0.81 | CYP1A2 (0.61) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2284651 | 0.81 | CYP1A2 (0.64) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL15196646 | 0.80 | CCR5 (0.63) | SLC6A4HTR6CYP1A2MAOBLMNA | |
| SCHEMBL23275535 | 0.80 | LRRK2 (0.54) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2936923 | 0.80 | MAOB (0.65) | CYP1A2CYP3A4CYP2D6MAPTCYP2C9 | |
| SCHEMBL1647303 | 0.78 | LRRK2 (0.67) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28631519 | 0.76 | MAOB (0.45) | SLC6A4HTR6CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2284937 | 0.76 | SLC6A4 (1.00) | SLC6A4HTR6HTR2C | |
| SCHEMBL15156306 | 0.75 | MAOB (0.73) | MAOB |
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-113444010-B | Preparation method of related substance of safinamide | 南京正大天晴制药有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-113444010-A | Preparation method of safinamide related substances | 南京正大天晴制药有限公司 | 2021-09-28 | — | — | CN | disclosed |