Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 10/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 8/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561140 | 1.00 | HTT (0.43) | HTTALDH1A1ITGA4ITGB1RAB9A | |
| SCHEMBL6560407 | 0.92 | ITGA4 (0.51) | HTTALDH1A1ITGA4ITGB1ITGB7 | |
| SCHEMBL6561753 | 0.92 | ITGA4 (0.51) | HTTALDH1A1ITGA4ITGB1ITGB7 | |
| SCHEMBL6560411 | 0.92 | ITGA4 (0.51) | HTTALDH1A1ITGA4ITGB1ITGB7 | |
| SCHEMBL6561171 | 0.88 | KMT2A (0.37) | ALDH1A1ITGA4ITGB1KMT2ATSHR | |
| SCHEMBL6561165 | 0.88 | KMT2A (0.37) | ALDH1A1ITGA4ITGB1KMT2ATSHR | |
| SCHEMBL6563252 | 0.84 | ITGB1 (0.54) | ITGA4ITGB1ITGB7 | |
| SCHEMBL6562652 | 0.84 | ITGB1 (0.54) | ITGA4ITGB1ITGB7 | |
| SCHEMBL6562648 | 0.84 | ITGB1 (0.54) | ITGA4ITGB1ITGB7 | |
| SCHEMBL6561274 | 0.80 | ITGB1 (0.45) | ITGA4ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1144365-B1 | INHIBITORS OF ALPHA-4 BETA-1 MEDIATED CELL ADHESION | TANABE SEIYAKU CO (JP) | 2004-03-17 | — | — | EP | disclosed |