Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.61 |
| ▸ | CASP3 | P42574 | 4/20 | 0.60 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | CASP7 | P55210 | 1/20 | 0.58 |
| ▸ | CASP9 | P55211 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | HTR2B | P41595 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6954598 | 0.99 | GAA (0.63) | GAACASP3CASP1CASP7CASP9 | |
| SCHEMBL6948048 | 0.88 | ALDH1A1 (0.57) | GAACASP3KDM4EMEN1KMT2A | |
| SCHEMBL6947705 | 0.86 | GAA (0.62) | GAAKDM4EPOLBMEN1KMT2A | |
| SCHEMBL8307191 | 0.85 | GAA (0.61) | GAAKDM4EPOLBMEN1KMT2A | |
| SCHEMBL7430586 | 0.84 | GAA (0.60) | GAAKDM4EPOLBMEN1KMT2A | |
| SCHEMBL6951357 | 0.84 | GAA (0.60) | GAACASP3CASP1CASP7CASP9 | |
| SCHEMBL7079432 | 0.81 | GAA (0.54) | GAACASP3CASP1CASP7CASP9 | |
| SCHEMBL6949259 | 0.80 | GAA (0.53) | GAAUSP2MEN1KMT2AALDH1A1 | |
| SCHEMBL7444177 | 0.80 | CYP3A4 (0.57) | GAACASP3CASP1CASP7CASP9 | |
| SCHEMBL7442190 | 0.80 | GAA (0.55) | GAACASP3CASP1CASP7CASP9 |
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-0988035-B1 | CASPASES AND APOPTOSIS | SMITHKLINE BEECHAM CORP (US) | 2003-05-02 | — | — | EP | claimed |