Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 9/20 | 0.41 |
| ▸ | CASP7 | P55210 | 6/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP9 | P55211 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.38 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18781745 | 0.88 | CASP3 (0.41) | CASP3CASP7CASP1CASP9CYP1A2 | |
| SCHEMBL7968633 | 0.88 | CASP3 (0.41) | CASP3CASP7CASP1CASP9CYP1A2 | |
| SCHEMBL7966457 | 0.80 | ADAMTS4 (0.47) | CASP3CASP7CASP1CASP9ADAMTS4 | |
| SCHEMBL15459287 | 0.79 | ALDH1A1 (0.48) | CASP3ALDH1A1MAPT | |
| SCHEMBL7890585 | 0.78 | CASP3 (0.46) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL18471610 | 0.74 | CASP3 (0.64) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL7968958 | 0.74 | CASP3 (0.64) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL9961861 | 0.74 | CASP3 (0.64) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL7975507 | 0.74 | CASP3 (0.64) | CASP3CASP7CASP1CASP9 | |
| SCHEMBL19015812 | 0.70 | CYP1A2 (0.40) | CYP1A2CYSLTR2CYSLTR1ALOX5KDM4E |
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-2009140765-A1 | SELECTIVE CASPASE INHIBITORS AND USES THEREOF | NEW WORLD LABORATORIES INC. (CA) | 2009-11-26 | — | — | WO | disclosed |