Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | EBP | Q15125 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5752500 | 0.69 | ALDH1A1 (0.43) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL20541511 | 0.68 | HTR2A (0.43) | ALDH1A1 | |
| SCHEMBL20541356 | 0.68 | HTR2A (0.43) | ALDH1A1 | |
| SCHEMBL7103282 | 0.68 | HTR2A (0.43) | ALDH1A1 | |
| SCHEMBL1837362 | 0.66 | TP53 (0.42) | SIGMAR1 | |
| SCHEMBL5757575 | 0.66 | OPRM1 (0.50) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5754789 | 0.65 | ALDH1A1 (0.51) | KCNH2ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5754428 | 0.64 | OPRM1 (0.46) | OPRM1OPRD1OPRK1 | |
| SCHEMBL564038 | 0.64 | POLB (0.43) | ALDH1A1 | |
| SCHEMBL3472313 | 0.64 | AOC3 (0.43) | — |
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-1140828-A1 | 3-AZABICYCLO[3.1.0]HEXANE DERIVATIVES AS OPIATE RECEPTORS LIGANDS | Pfizer Limited (GB) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000039089-A1 | 3-AZABICYCLO[3.1.0.] HEXANE DERIVATIVES AS OPIATE RECEPTORS LIGANDS | PFIZER LIMITED (GB) | 2000-07-06 | — | — | WO | disclosed |