Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | DEPTOR | Q8TB45 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2796840 | 0.84 | TSHR (0.44) | ALDH1A1HPGDCES2CES1EGFR | |
| SCHEMBL8778253 | 0.77 | ELANE (0.46) | ALDH1A1HPGDELANECES2CES1 | |
| SCHEMBL13604121 | 0.76 | HSD11B1 (0.46) | ALDH1A1HPGDELANECES2CES1 | |
| SCHEMBL22026740 | 0.74 | TDP1 (0.35) | HSD17B10TSHR | |
| SCHEMBL1951213 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HPGDELANECYP1A2CYP2D6 | |
| SCHEMBL10996635 | 0.74 | ELANE (0.43) | ALDH1A1HPGDELANECES2CES1 | |
| SCHEMBL8778087 | 0.74 | ELANE (0.43) | ALDH1A1HPGDELANECES2CES1 | |
| SCHEMBL3183842 | 0.74 | ALDH1A1 (0.49) | ALDH1A1HPGDELANECES2CES1 | |
| SCHEMBL2282162 | 0.73 | KMT2A (0.53) | ALDH1A1HPGDEGFRHSD11B1KMT2A | |
| SCHEMBL7573934 | 0.73 | HPGD (0.56) | ALDH1A1HPGDCES2CES1EGFR |
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-2350000-A1 | PIPERAZINE DERIVATIVES FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010028776-A1 | PIPERAZINE DERIVATIVES FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-03-18 | — | — | WO | disclosed |