Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 9/20 | 0.58 |
| ▸ | ITGA4 | P13612 | 9/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6512426 | 0.90 | ITGB1 (0.53) | ITGB1ITGA4MAPTRAB9AALDH1A1 | |
| SCHEMBL6509549 | 0.86 | ITGB1 (0.63) | ITGB1ITGA4 | |
| SCHEMBL6512435 | 0.82 | ITGB1 (0.57) | ITGB1ITGA4MAPTRAB9AALDH1A1 | |
| SCHEMBL6516994 | 0.81 | ITGB1 (0.46) | ITGB1ITGA4MAPT | |
| SCHEMBL6513196 | 0.80 | ITGB1 (0.53) | ITGB1ITGA4KMT2A | |
| SCHEMBL6513291 | 0.80 | ITGB1 (0.48) | ITGB1ITGA4RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL6510295 | 0.79 | LMNA (0.43) | ITGB1ITGA4ALDH1A1MEN1KMT2A | |
| SCHEMBL6518236 | 0.78 | ITGB1 (0.52) | ITGB1ITGA4RAB9ASMN1; SMN2 | |
| SCHEMBL6512464 | 0.78 | SMN1; SMN2 (0.52) | ITGB1ITGA4SMN1; SMN2 | |
| SCHEMBL6512380 | 0.78 | ITGA4 (0.50) | ITGB1ITGA4SMN1; SMN2 |
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-6953798-B1 | β-alanine derivates | CELLTECH R&D LIMITED (GB) | 2005-10-11 | — | — | US | disclosed |