Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 10/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL25244120 | 1.00 | AKR1C3 (0.40) | AKR1C3TBXAS1HDAC2KDM4EALDH1A1 | |
| SCHEMBL25576865 | 0.83 | MAPT (0.35) | HDAC2KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL21001995 | 0.77 | HDAC2 (0.49) | HDAC2ALDH1A1HDAC4 | |
| SCHEMBL21001867 | 0.73 | AKR1C3 (0.48) | AKR1C3TBXAS1HDAC2ALDH1A1L3MBTL1 | |
| SCHEMBL18282733 | 0.72 | ACHE (0.49) | ALDH1A1ACHEMAPTBRD4CREBBP | |
| SCHEMBL21001960 | 0.71 | HDAC2 (0.45) | HDAC2ALDH1A1HPGDMAPTROCK1 | |
| SCHEMBL21039906 | 0.70 | NPC1 (0.56) | HDAC2ALDH1A1HPGDMAPT | |
| SCHEMBL2148413 | 0.70 | L3MBTL1 (0.57) | ACHEBRD4CREBBPROCK1L3MBTL1 | |
| SCHEMBL27944353 | 0.69 | AKR1C3 (0.47) | AKR1C3TBXAS1ALDH1A1 | |
| SCHEMBL23570884 | 0.69 | HIF1A (0.50) | ALDH1A1MAPTBRD4CREBBPROCK1 |
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-2023097234-A1 | SPIROCYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION | GENENTECH, INC. (US) | 2023-06-01 | — | — | WO | disclosed |