Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30460492 | 1.00 | HTT (0.60) | HTTSMN1; SMN2L3MBTL1TSHRALDH1A1 | |
| SCHEMBL30460495 | 0.82 | CYP2C9 (0.52) | TSHRALDH1A1LMNAFKBP1AGAA | |
| SCHEMBL30460643 | 0.82 | CYP2C9 (0.52) | TSHRALDH1A1LMNAFKBP1AGAA | |
| SCHEMBL25266163 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25202155 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25218421 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25206507 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25194678 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25206506 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT | |
| SCHEMBL25197324 | 0.80 | FKBP1A (0.59) | SMN1; SMN2ALDH1A1LMNAFKBP1AAADAT |
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-2023090853-A1 | NOVEL UREA-BASED OR CARBAMATE-BASED P2X7 RECEPTOR ANTAGONIST, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING MAJOR DEPRESSIVE DISORDER, COMPRISING SAME AS ACTIVE INGREDIENT | 고려대학교 세종산학협력단 | 2023-05-25 | — | — | WO | disclosed |