Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | FBP1 | P09467 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | FABP6 | P51161 | 1/20 | 0.43 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6990747 | 0.99 | ALDH1A1 (0.51) | ALDH1A1HPGDEPHX2P2RY12KDM4E | |
| SCHEMBL6987979 | 0.84 | KDM4E (0.59) | ALDH1A1KDM4ELMNAKMT2AHTT | |
| Hydrochloric Acid SCHEMBL6991722 | 0.83 | KDM4E (0.58) | ALDH1A1KDM4ELMNAKMT2AHTT | |
| Hydrochloric Acid SCHEMBL6990408 | 0.81 | KMT2A (0.51) | ALDH1A1KDM4EMAPTKMT2AGAA | |
| SCHEMBL6987380 | 0.81 | CTDSP1 (0.57) | P2RY12KDM4ELMNAPKMKMT2A | |
| Hydrochloric Acid SCHEMBL6987696 | 0.80 | CTDSP1 (0.56) | P2RY12KDM4ELMNAPKMKMT2A | |
| SCHEMBL5465081 | 0.79 | KMT2A (0.61) | ALDH1A1HPGDEPHX2P2RY12KDM4E | |
| SCHEMBL6992011 | 0.78 | PKM (0.59) | KDM4EPKMKMT2AMEN1 | |
| SCHEMBL6987336 | 0.78 | CNR1 (0.59) | KDM4EKMT2AGAAHTTMEN1 | |
| Hydrochloric Acid SCHEMBL6989166 | 0.77 | PKM (0.58) | KDM4EPKMKMT2AMEN1 |
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-1343775-A2 | PIPERAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002048124-A2 | PIPERAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-20 | — | — | WO | disclosed |