Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5080598 | 0.85 | ROCK2 (0.40) | TP53ROCK2ROCK1BRD4HSD11B1 | |
| SCHEMBL5086472 | 0.79 | ROCK2 (0.59) | ROCK2ROCK1MEN1KMT2AKDM4E | |
| SCHEMBL5083135 | 0.78 | CHRM1 (0.43) | TP53ROCK2ROCK1HSD11B1ALDH1A1 | |
| SCHEMBL7328966 | 0.78 | ALDH1A1 (0.41) | TP53ROCK2ROCK1BRD4HSD11B1 | |
| SCHEMBL4727409 | 0.72 | POLB (0.47) | TP53ROCK2ROCK1BRD4ALDH1A1 | |
| SCHEMBL4729409 | 0.71 | ROCK2 (0.60) | ROCK2ROCK1MEN1KMT2AKDM4E | |
| SCHEMBL4726942 | 0.70 | TAAR1 (0.46) | ROCK2ROCK1ALDH1A1MEN1KMT2A | |
| SCHEMBL4727540 | 0.68 | FABP6 (0.47) | ROCK2ROCK1ALDH1A1MEN1KMT2A | |
| SCHEMBL4783168 | 0.68 | ROCK2 (0.68) | TP53ROCK2ROCK1MEN1KMT2A | |
| SCHEMBL4729584 | 0.67 | ROCK2 (0.59) | TP53ROCK2ROCK1MEN1KMT2A |
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-2008021210-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-02-21 | — | — | WO | disclosed |