Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 4/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.33 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29732390 | 1.00 | GRIN1 (0.35) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL29804944 | 0.81 | HDAC4 (0.40) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL29731869 | 0.79 | AKR1B1 (0.34) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL23645062 | 0.72 | PDE7A (0.37) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL29732118 | 0.72 | PDE7A (0.37) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL29732106 | 0.72 | PDE7A (0.37) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL29732120 | 0.70 | HDAC4 (0.34) | SLC6A4HDAC4 | |
| SCHEMBL29732177 | 0.70 | HDAC4 (0.34) | SLC6A4HDAC4 | |
| SCHEMBL29804750 | 0.69 | GRIN1 (0.33) | GRIN1GRIN2ASLC6A4GRIN2DGRIN3B | |
| SCHEMBL23644286 | 0.69 | MEN1 (0.30) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805311-B | Spirocyclic indenes | 苏州亚盛药业有限公司 | 2024-10-29 | — | — | CN | disclosed |
| CN-114805311-A | Spirocyclic indenes | 苏州亚盛药业有限公司 | 2022-07-29 | — | — | CN | disclosed |
| WO-2022156761-A1 | SPIROCYCLIC INDENES | ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) | 2022-07-28 | — | — | WO | disclosed |