Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPFFR1 | Q9GZQ6 | 17/20 | 0.60 |
| ▸ | NPFFR2 | Q9Y5X5 | 17/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8709388 | 0.85 | HTT (0.46) | NPFFR1NPFFR2OPRK1ALDH1A1OPRM1 | |
| SCHEMBL8707282 | 0.77 | CYP2D6 (0.50) | ALDH1A1NPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL20572136 | 0.74 | NPFFR1 (0.60) | NPFFR1NPFFR2OPRK1ALDH1A1OPRM1 | |
| SCHEMBL4630062 | 0.73 | NPFFR1 (0.58) | NPFFR1NPFFR2OPRK1ALDH1A1 | |
| SCHEMBL8393626 | 0.73 | USP2 (0.64) | ALDH1A1HTT | |
| SCHEMBL4631287 | 0.73 | NPFFR1 (0.57) | NPFFR1NPFFR2OPRK1ALDH1A1 | |
| SCHEMBL8708218 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL12195395 | 0.73 | NPFFR1 (0.58) | NPFFR1NPFFR2OPRK1ALDH1A1 | |
| SCHEMBL16915597 | 0.72 | NPFFR1 (0.57) | NPFFR1NPFFR2OPRK1ALDH1A1OPRM1 | |
| SCHEMBL5995214 | 0.72 | POLB (0.77) | ALDH1A1OPRM1OPRD1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998018762-A1 | NEW DERIVATIVES OF DIVERSELY SUBSTITUTED CYCLICAL AMIDE SELECTIVE ANTAGONISTS OF THE HUMAN RECEPTOR NK3, PROCESS FOR OBTAINING THEM, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SANOFI (FR) | 1998-05-07 | — | — | WO | disclosed |