Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 4/20 | 0.35 |
| ▸ | CES1 | P23141 | 4/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24006702 | 0.83 | RECQL (0.35) | HRH4RECQLCES2CES1MAPK14 | |
| SCHEMBL24007928 | 0.79 | HRH4 (0.38) | HRH4RECQLMAPK14 | |
| SCHEMBL1408588 | 0.78 | ACE2 (0.38) | RXRATRPA1LMNACHRM1SLC6A2 | |
| SCHEMBL7912361 | 0.78 | CA1 (0.37) | CES2MEN1KMT2ATRPA1LMNA | |
| SCHEMBL21207989 | 0.77 | CES2 (0.41) | HRH4CES2CES1 | |
| SCHEMBL7288273 | 0.77 | KEAP1 (0.48) | RECQLCES2CES1 | |
| SCHEMBL7281400 | 0.76 | CES2 (0.42) | RECQLCES2CES1MAPK14PSEN1 | |
| SCHEMBL13689710 | 0.75 | CES2 (0.56) | CES2CES1MEN1KMT2A | |
| SCHEMBL29727310 | 0.75 | CES2 (0.56) | CES2CES1MEN1KMT2A | |
| SCHEMBL13651368 | 0.75 | GCGR (0.37) | HRH4RECQLGCGRRXRA |
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 |