Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24007490 | 0.84 | MEN1 (0.38) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL25985714 | 0.77 | LMNA (0.39) | CYP1A2 | |
| SCHEMBL12197672 | 0.75 | CYP1A2 (0.39) | RECQLHRH4PSEN1PSEN2APH1B | |
| SCHEMBL12040771 | 0.74 | RECQL (0.36) | RECQLHRH4PSEN1PSEN2APH1B | |
| SCHEMBL10039364 | 0.74 | RECQL (0.36) | RECQLHRH4PSEN1PSEN2APH1B | |
| SCHEMBL423296 | 0.73 | PSEN1 (0.49) | RECQLHRH4PSEN1PSEN2APH1B | |
| SCHEMBL14566097 | 0.73 | ALDH1A1 (0.42) | CYP1A2CYP2A6CES2CES1 | |
| SCHEMBL25985208 | 0.72 | GABRA1 (0.31) | — | |
| SCHEMBL800711 | 0.71 | HRH4 (0.40) | RECQLHRH4PSEN1PSEN2APH1B | |
| SCHEMBL423349 | 0.71 | KCNH2 (0.45) | RECQLHRH4PSEN1PSEN2APH1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021226208-A2 | HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS | NUVALENT, INC. (US) | 2021-11-11 | — | — | WO | disclosed |