Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.48 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PNP | P00491 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28581282 | 0.81 | HDAC3 (0.43) | PIK3CDPIK3CBHTR6HDAC3HDAC4 | |
| SCHEMBL28589168 | 0.81 | PIK3CD (0.48) | PIK3CDPIK3CBHTR6HDAC3HDAC4 | |
| SCHEMBL433715 | 0.78 | MAPK1 (0.53) | HDAC6NPC1L3MBTL1MAPK1NOTUM | |
| SCHEMBL29167134 | 0.78 | HTR6 (0.64) | PIK3CDPIK3CBHTR6ADORA3ADORA1 | |
| SCHEMBL11840368 | 0.77 | HDAC3 (0.45) | PIK3CDPIK3CBHTR6HDAC3HDAC4 | |
| SCHEMBL28578836 | 0.73 | HDAC3 (0.45) | PIK3CDPIK3CBHDAC3HDAC4HDAC1 | |
| SCHEMBL14688312 | 0.72 | PNP (0.45) | PIK3CDPIK3CBHTR6ADORA3ADORA1 | |
| SCHEMBL31745005 | 0.72 | ADORA1 (0.54) | PIK3CDPIK3CBHTR6ADORA3ADORA1 | |
| SCHEMBL14366318 | 0.71 | TSHR (0.46) | HTR6ADORA3ADORA1TAAR1LMNA | |
| SCHEMBL559559 | 0.71 | TAAR1 (0.56) | L3MBTL1TAAR1LMNATSHRADRA1D |
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 |
|---|---|---|---|---|---|---|---|
| US-3960849-A | BACTERICIDES | E. R. SQUIBB & SONS, INC. (US) | 1976-06-01 | — | — | US | disclosed |