Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 5/20 | 0.67 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.59 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.54 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.54 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | DOCK5 | Q9H7D0 | 1/20 | 0.47 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9495770 | 0.88 | MCHR1 (0.65) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL8812119 | 0.87 | MCHR1 (0.57) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL7841441 | 0.86 | MCHR1 (0.59) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL3479520 | 0.85 | BACE1 (0.73) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL3479519 | 0.85 | BACE1 (0.73) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL8197624 | 0.84 | BACE1 (0.51) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL594067 | 0.83 | BACE1 (0.58) | BACE1MCHR1OPRL1OPRM1OPRD1 | |
| SCHEMBL3479511 | 0.82 | BACE1 (0.58) | BACE1MCHR1BACE2 | |
| SCHEMBL3479443 | 0.82 | BACE1 (0.58) | BACE1MCHR1BACE2 | |
| SCHEMBL3479445 | 0.82 | BACE1 (0.58) | BACE1MCHR1BACE2 |
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-2008030412-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-03-13 | — | — | WO | disclosed |