Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 3/20 | 0.34 |
| ▸ | CES1 | P23141 | 3/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL24006703 | 0.83 | HRH4 (0.38) | RECQLHRH4CES2CES1MAPK14 | |
| SCHEMBL24007928 | 0.80 | HRH4 (0.38) | RECQLHRH4MAPK14 | |
| SCHEMBL24006762 | 0.80 | HRH4 (0.37) | RECQLHRH4CES2CES1MAPK14 | |
| SCHEMBL7288273 | 0.76 | KEAP1 (0.48) | RECQLCES2CES1KEAP1 | |
| SCHEMBL7281400 | 0.74 | CES2 (0.42) | RECQLCES2CES1MAPK14KEAP1 | |
| SCHEMBL19519579 | 0.74 | GABRA1 (0.48) | NOS3NOS1 | |
| SCHEMBL24006646 | 0.74 | HRH4 (0.33) | RECQLHRH4MAPK14 | |
| SCHEMBL24007412 | 0.73 | HRH4 (0.39) | HRH4CES2CES1KEAP1NOS3 | |
| SCHEMBL18375724 | 0.71 | SLC6A4 (0.45) | RECQLCES2CES1 | |
| SCHEMBL12197672 | 0.71 | CYP1A2 (0.39) | RECQLHRH4CES2CES1PSEN1 |
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 |