Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | TOP1 | P11387 | 1/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL28855427 | 1.00 | GRM5 (0.49) | GRM5MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL28855630 | 0.79 | MEN1 (0.51) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL29901207 | 0.79 | BACE1 (0.53) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL14191577 | 0.79 | BACE1 (0.53) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL29901056 | 0.79 | MEN1 (0.51) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL5579693 | 0.79 | GRM5 (0.57) | GRM5MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL8388636 | 0.78 | ALDH1A1 (0.55) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL30832846 | 0.77 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL1663438 | 0.77 | MEN1 (0.57) | MEN1KMT2ARAB9ANPC1ATM | |
| SCHEMBL5164310 | 0.77 | BACE1 (0.54) | MEN1KMT2ARAB9ANPC1ATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-4110776-A1 | NEW MACROCYCLIC COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Les Laboratoires Servier (FR) | 2023-01-04 | — | — | EP | disclosed |
| CN-115151538-A | Macrocyclic compounds, process for their preparation and pharmaceutical compositions containing them | 法国施维雅药厂 | 2022-10-04 | — | — | CN | disclosed |