Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.41 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Bencyclane SCHEMBL64881 | 0.84 | AQP3 (0.44) | HRH3CYP2D6OPRM1ADRA2AKDM4E | |
| Dimethylamine SCHEMBL11444308 | 0.81 | NPFFR1 (0.43) | OPRL1CYP2D6KDM4EPOLBCYP3A4 | |
| Bencyclane SCHEMBL1568812 | 0.76 | HRH1 (0.52) | KDM4ECHRM2CHRM1ALDH1A1AQP3 | |
| Bencyclane SCHEMBL220903 | 0.76 | HRH1 (0.52) | KDM4ECHRM2CHRM1ALDH1A1AQP3 | |
| SCHEMBL13681480 | 0.76 | AQP3 (0.50) | HRH3CYP2D6OPRM1ADRA2AKDM4E | |
| Bencyclane SCHEMBL20505617 | 0.75 | HRH1 (0.51) | KDM4ECHRM2CHRM1ALDH1A1AQP3 | |
| SCHEMBL14409639 | 0.74 | AQP3 (0.48) | HRH3CYP2D6OPRM1ADRA2AKDM4E | |
| SCHEMBL13503985 | 0.73 | AQP3 (0.47) | HRH3OPRL1CYP2D6OPRM1ADRA2A | |
| SCHEMBL11666639 | 0.71 | AQP1 (0.43) | KDM4ECHRM2CHRM1POLBALDH1A1 | |
| SCHEMBL11151306 | 0.69 | OPRL1 (0.54) | OPRL1CYP2D6OPRM1CYP1A2POLB |
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 |
|---|---|---|---|---|---|---|---|
| JP-55072170-A | — | — | None | — | — | JP | disclosed |
| JP-S5572170-A | NOVEL AZACYCLOALKANE DERIVATIVE AND ITS PREPARATION | SUMITOMO CHEM CO LTD | 1980-05-30 | — | — | JP | disclosed |