Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | BCL2 | P10415 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5099673 | 0.98 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP2C9CYP2C19SIGMAR1 | |
| SCHEMBL23880652 | 0.82 | CYP2D6 (0.44) | CYP3A4CYP2D6CYP2C9CYP2C19SIGMAR1 | |
| SCHEMBL5089212 | 0.80 | SIGMAR1 (0.61) | CYP2D6SIGMAR1BCL2LMNACHRM4 | |
| SCHEMBL11836940 | 0.78 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C9CYP2C19SIGMAR1 | |
| SCHEMBL5091772 | 0.78 | SIGMAR1 (0.59) | CYP2D6SIGMAR1BCL2LMNACHRM4 | |
| SCHEMBL5093688 | 0.78 | SIGMAR1 (0.59) | CYP2D6SIGMAR1BCL2LMNACHRM4 | |
| SCHEMBL11024439 | 0.77 | CYP3A4 (0.50) | CYP3A4CYP2D6CYP2C9CYP2C19PTPN1 | |
| SCHEMBL11868000 | 0.73 | BCL2 (0.49) | CYP2D6SIGMAR1BCL2KMT2AL3MBTL1 | |
| SCHEMBL6352845 | 0.72 | SIRT2 (0.33) | CYP3A4CYP2D6CYP2C9CYP2C19PTPN1 | |
| SCHEMBL3885050 | 0.70 | CYP3A4 (0.52) | CYP3A4CYP2D6CYP2C9CYP2C19KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0727421-B1 | Agents for improving sleep | JANSSEN PHARMACEUTICA NV (BE) | 2001-10-24 | — | — | EP | disclosed |
| EP-0727421-A1 | Agents for improving sleep | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-08-21 | — | — | EP | disclosed |
| US-5026853-A | Sleep and cardiovascular disorders | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-06-25 | — | — | US | disclosed |
| US-4968684-A | N-ARYL-PIPERAZINEALKANAMIDE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1990-11-06 | — | — | US | disclosed |
| US-4880808-A | SEDATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-11-14 | — | — | US | disclosed |
| EP-0285219-A2 | Method of improving sleep | JANSSEN PHARMACEUTICA N.V. (BE) | 1988-10-05 | — | — | EP | disclosed |