Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.59 |
| ▸ | CNR2 | P34972 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | NAAA | Q02083 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 SCHEMBL6989767 | 0.99 | CNR1 (0.58) | CNR1CNR2KMT2AMEN1HTT | |
| Hydrochloric Acid SCHEMBL6990408 | 0.86 | KMT2A (0.51) | CNR1CNR2KMT2AMEN1HTT | |
| Hydrochloric Acid SCHEMBL6988072 | 0.84 | EPHX2 (0.42) | CNR1CNR2KMT2AMEN1HTT | |
| SCHEMBL6987979 | 0.81 | KDM4E (0.59) | KMT2AMEN1HTTPOLBTDP1 | |
| Hydrochloric Acid SCHEMBL6991722 | 0.80 | KDM4E (0.58) | KMT2AMEN1HTTPOLBTDP1 | |
| SCHEMBL6991815 | 0.78 | ALDH1A1 (0.52) | KMT2AMEN1HTTGAAKDM4E | |
| SCHEMBL11048848 | 0.78 | DRD2 (0.71) | CNR1CNR2KMT2AMEN1HTT | |
| Hydrochloric Acid SCHEMBL6990543 | 0.78 | LMNA (0.44) | KMT2AMEN1POLBKDM4E | |
| Hydrochloric Acid SCHEMBL6990747 | 0.77 | ALDH1A1 (0.51) | KMT2AMEN1HTTGAAKDM4E | |
| SCHEMBL6987678 | 0.76 | CYP3A4 (0.47) | CNR1POLBGAASMN1; 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 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 |