Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.61 |
| ▸ | HTR1A | P08908 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.61 |
| ▸ | HTR2C | P28335 | 1/20 | 0.61 |
| ▸ | HTR2B | P41595 | 1/20 | 0.61 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.61 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.61 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11096032 | 0.99 | DRD2 (0.61) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11096050 | 0.90 | DRD2 (0.62) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11664292 | 0.90 | CHRM1 (0.60) | DRD2OPRM1OPRK1OPRL1CHRM1 | |
| SCHEMBL11101398 | 0.89 | DRD2 (0.62) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11095945 | 0.89 | DRD2 (0.62) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11098294 | 0.89 | OPRM1 (0.62) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11097105 | 0.89 | OPRM1 (0.66) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL11257252 | 0.89 | CHRM1 (0.59) | DRD2OPRM1OPRK1OPRL1CHRM1 | |
| SCHEMBL11024037 | 0.88 | OPRM1 (0.58) | DRD2HTR1AHTR2AHTR2CHTR2B | |
| SCHEMBL11101393 | 0.88 | DRD2 (0.59) | DRD2HTR1AHTR2AHTR2CHTR2B |
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-1960347-B1 | 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS | STERIX LTD (GB) | 2012-06-20 | — | — | EP | disclosed |
| EP-0068261-A1 | N-oxacyclyl-alkylpiperidine derivatives, their preparation, pharmaceutical preparations containing them and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-01-05 | — | — | EP | disclosed |