Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | COMT | P21964 | 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 | |
|---|---|---|---|---|
| SCHEMBL25107828 | 0.84 | HTT (0.31) | HTTSMN1; SMN2 | |
| SCHEMBL25109591 | 0.80 | HTT (0.40) | HTTSMN1; SMN2LMNAALDH1A1L3MBTL1 | |
| SCHEMBL25109432 | 0.74 | IDO1 (0.41) | HTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL20086560 | 0.71 | LMNA (0.34) | HTTSMN1; SMN2LMNAALDH1A1L3MBTL1 | |
| SCHEMBL24908122 | 0.70 | NMT1 (0.30) | — | |
| SCHEMBL25108426 | 0.70 | HTR2A (0.32) | — | |
| SCHEMBL25109751 | 0.69 | HTT (0.33) | HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL26481679 | 0.69 | L3MBTL1 (0.41) | HTTSMN1; SMN2LMNAALDH1A1L3MBTL1 | |
| SCHEMBL25107870 | 0.69 | LRRK2 (0.33) | — | |
| SCHEMBL24090319 | 0.69 | COMT (0.35) | HTTSMN1; SMN2LMNAALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023196900-A9 | SOLID FORMS, PHARMACEUTICAL COMPOSITIONS AND PREPARATION OF HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS | NUVALENT, INC. (US) | 2024-07-04 | — | — | WO | disclosed |
| WO-2023196900-A1 | SOLID FORMS, PHARMACEUTICAL COMPOSITIONS AND PREPARATION OF HETEROAROMATIC MACROCYCLIC ETHER COMPOUNDS | NUVALENT, INC. (US) | 2023-10-12 | — | — | WO | disclosed |