Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7106003 | 0.83 | MAOA (0.56) | CES1MAOBMAOATSHRSRD5A2 | |
| Dihydrophenanthrene SCHEMBL29404495 | 0.82 | CES1 (0.68) | CES1MAOBCYP2A6MAOASETD7 | |
| Dihydrophenanthrene SCHEMBL155991 | 0.82 | CES1 (0.68) | CES1MAOBCYP2A6MAOASETD7 | |
| Dihydrophenanthrene SCHEMBL30297028 | 0.82 | CES1 (0.68) | CES1MAOBCYP2A6MAOASETD7 | |
| SCHEMBL6753858 | 0.81 | CES1 (0.54) | CES1MAOBCYP2A6MAOASETD7 | |
| Dihydrophenanthrene SCHEMBL28858771 | 0.79 | CES1 (0.65) | CES1MAOBCYP2A6MAOASETD7 | |
| Dihydrophenanthrene SCHEMBL28876918 | 0.79 | CES1 (0.65) | CES1MAOBCYP2A6MAOASETD7 | |
| SCHEMBL30436624 | 0.79 | CES1 (0.65) | CES1MAOBCYP2A6MAOASETD7 | |
| SCHEMBL9073674 | 0.78 | CES1 (0.56) | CES1MAOBCYP2A6MAOASETD7 | |
| SCHEMBL18938578 | 0.77 | CES1 (0.62) | CES1MAOBCYP2A6MAOASETD7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4119536-A1 | PREPARATION OF A PHARMACEUTICAL INTERMEDIATE | Dipharma Francis S.r.l. (IT) | 2023-01-18 | — | — | EP | disclosed |