Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL28998941 | 1.00 | MAP4K3 (0.32) | MAP4K3MAPK14NPC1HTTRAB9A | |
| SCHEMBL30228003 | 0.85 | GRM5 (0.32) | MAP4K3NPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL28998917 | 0.85 | GRM5 (0.32) | MAP4K3NPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL28982110 | 0.79 | — | — | |
| SCHEMBL28982112 | 0.72 | JAK2 (0.41) | — | |
| SCHEMBL30295575 | 0.72 | JAK2 (0.41) | — | |
| SCHEMBL30242765 | 0.72 | NPC1 (0.34) | NPC1RAB9AGRM5 | |
| SCHEMBL25624480 | 0.72 | NPC1 (0.34) | NPC1RAB9AGRM5 | |
| SCHEMBL24014348 | 0.72 | GRM5 (0.32) | GRM5 | |
| SCHEMBL26537434 | 0.71 | ADCY10 (0.35) | MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115916196-A | Heteroaromatic macrocyclic ether chemotherapeutic agents | 纽威伦特公司 | 2023-04-04 | — | — | CN | disclosed |
| EP-4146205-A1 | HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS | Nuvalent, Inc. (US) | 2023-03-15 | — | — | EP | disclosed |