Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAFG | O15525 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 6/20 | 0.38 |
| ▸ | CASP1 | P29466 | 4/20 | 0.38 |
| ▸ | CASP9 | P55211 | 3/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.36 |
| ▸ | CASP2 | P42575 | 1/20 | 0.36 |
| ▸ | CASP4 | P49662 | 1/20 | 0.35 |
| ▸ | CASP5 | P51878 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | IDE | P14735 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RIN1 | Q13671 | 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 | |
|---|---|---|---|---|
| SCHEMBL2037323 | 0.84 | TDP1 (0.51) | MAFGCASP3CASP1CASP7CASP8 | |
| SCHEMBL6534725 | 0.80 | CASP3 (0.55) | MAFGCASP3CASP1CASP7CASP8 | |
| SCHEMBL5406043 | 0.76 | TDP1 (0.56) | MAFGCASP3CASP1CASP7CASP8 | |
| SCHEMBL17930179 | 0.72 | CASP3 (0.48) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL13194679 | 0.71 | CASP1 (0.50) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL4100803 | 0.71 | CASP1 (0.50) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL29310042 | 0.71 | CASP1 (0.50) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL1674857 | 0.71 | CASP1 (0.50) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL20257263 | 0.70 | TASP1 (0.53) | CASP3CASP1CASP9CASP7CASP8 | |
| SCHEMBL20257260 | 0.70 | TASP1 (0.53) | CASP3CASP1CASP9CASP7CASP8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0822983-A4 | APOPAIN | MERCK & CO INC (US) | 2004-12-15 | — | — | EP | disclosed |
| EP-0822983-A1 | APOPAIN | Merck & Co., Inc. (US) | 1998-02-11 | — | — | EP | disclosed |
| WO-1996033268-A1 | APOPAIN | MERCK & CO., INC. (US) | 1996-10-24 | — | — | WO | disclosed |