Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 4/20 | 0.64 |
| ▸ | CTSS | P25774 | 2/20 | 0.64 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.52 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.52 |
| ▸ | RPS6KA4 | O75676 | 2/20 | 0.52 |
| ▸ | PRKACA | P17612 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | GSK3B | P49841 | 2/20 | 0.52 |
| ▸ | PRKX | P51817 | 2/20 | 0.52 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.52 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.52 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.52 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.52 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7243622 | 0.95 | CAPN1 (0.70) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7233164 | 0.90 | CAPN1 (0.62) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7239751 | 0.89 | CAPN1 (0.59) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7241202 | 0.88 | CHIA (0.59) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7242740 | 0.87 | CAPN1 (0.57) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7232925 | 0.86 | CAPN1 (0.59) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7243109 | 0.86 | CAPN1 (0.56) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7242752 | 0.85 | CAPN1 (0.63) | CAPN1CTSSTSHRHSD17B10KDM4E | |
| SCHEMBL7235665 | 0.84 | CAPN1 (0.55) | CAPN1CTSSROCK2ROCK1RPS6KA5 | |
| SCHEMBL7238990 | 0.83 | CAPN1 (0.54) | CAPN1CTSSROCK2ROCK1RPS6KA5 |
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-6562827-B1 | For the treatment of diseases in which increased calpain activity occurs such as neurodegenerative diseases or neuronal damage are caused by ischemia, trauma or mass hemorrhages | ABBOTT LABORATORIES | 2003-05-13 | — | — | US | disclosed |