Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17698141 | 1.00 | PDK1 (0.37) | PDK1ALDH1A1LMNAHSD17B10NLRP3 | |
| SCHEMBL17698142 | 1.00 | PDK1 (0.37) | PDK1ALDH1A1LMNAHSD17B10NLRP3 | |
| SCHEMBL14801585 | 0.83 | PDK1 (0.35) | PDK1NLRP3 | |
| SCHEMBL23930941 | 0.81 | GBA1 (0.31) | — | |
| SCHEMBL14805523 | 0.79 | NR1H2 (0.47) | ALDH1A1 | |
| SCHEMBL6127402 | 0.79 | CHRNB2 (0.31) | — | |
| SCHEMBL9928687 | 0.79 | CHRNB2 (0.31) | — | |
| SCHEMBL23930809 | 0.76 | — | — | |
| SCHEMBL8172437 | 0.76 | CHRNB2 (0.36) | PDK1LMNAHSD17B10 | |
| SCHEMBL15563756 | 0.75 | ACE (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2758402-B9 | PYRROLOPYRIMIDINE AND PURINE DERIVATIVES | PFIZER (US) | 2016-09-14 | — | — | EP | disclosed |
| EP-2758402-B1 | PYRROLOPYRIMIDINE AND PURINE DERIVATIVES | PFIZER (US) | 2016-04-27 | — | — | EP | disclosed |