Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | F2 | P00734 | 1/20 | 0.52 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.48 |
| ▸ | TUBB | P07437 | 1/20 | 0.48 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.48 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.48 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.48 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.48 |
| ▸ | TUBB3 | Q13509 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6991722 | 0.99 | KDM4E (0.58) | KDM4EHRH3MEN1KMT2ANPSR1 | |
| SCHEMBL6992011 | 0.88 | PKM (0.59) | KDM4EHRH3MEN1KMT2A | |
| SCHEMBL6987380 | 0.88 | CTDSP1 (0.57) | KDM4EHRH3MEN1KMT2ANPSR1 | |
| Hydrochloric Acid SCHEMBL6987696 | 0.87 | CTDSP1 (0.56) | KDM4EHRH3MEN1KMT2ANPSR1 | |
| Hydrochloric Acid SCHEMBL6989166 | 0.87 | PKM (0.58) | KDM4EHRH3MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6990408 | 0.84 | KMT2A (0.51) | KDM4EMEN1KMT2ASMN1; SMN2HTT | |
| SCHEMBL6991815 | 0.84 | ALDH1A1 (0.52) | KDM4EMEN1KMT2ALMNAHTT | |
| Hydrochloric Acid SCHEMBL6990747 | 0.83 | ALDH1A1 (0.51) | KDM4EMEN1KMT2ALMNAHTT | |
| SCHEMBL4677795 | 0.82 | LMNA (0.45) | KDM4EMEN1KMT2ALMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL6988072 | 0.82 | EPHX2 (0.42) | KDM4EMEN1KMT2ATPSAB1SMN1; SMN2 |
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 4 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 | claimed |
| WO-2002048124-A2 | PIPERAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-20 | — | — | WO | claimed |
| 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 |