Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9797668 | 1.00 | RARB (0.49) | RARBDRD2DRD4DRD3NR5A1 | |
| SCHEMBL9797733 | 1.00 | RARB (0.49) | RARBDRD2DRD4DRD3NR5A1 | |
| SCHEMBL9798302 | 0.99 | RARB (0.47) | RARBDRD2DRD4DRD3NR5A1 | |
| SCHEMBL9798261 | 0.96 | HPGD (0.47) | RARBDRD2DRD4DRD3HRH3 | |
| SCHEMBL9797873 | 0.91 | TSHR (0.47) | HRH3HPGDMEN1KMT2ALMNA | |
| SCHEMBL9798013 | 0.85 | ALDH1A1 (0.42) | HRH3KMT2AALDH1A1 | |
| SCHEMBL9810388 | 0.83 | RARB (0.49) | RARBDRD2DRD4DRD3MEN1 | |
| SCHEMBL9810412 | 0.83 | RARB (0.49) | RARBDRD2DRD4DRD3MEN1 | |
| SCHEMBL9810331 | 0.83 | RARB (0.49) | RARBDRD2DRD4DRD3MEN1 | |
| SCHEMBL9810463 | 0.83 | RARB (0.49) | RARBDRD2DRD4DRD3MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0261160-B1 | ALICYCLIC COMPOUNDS | MERCK PATENT GmbH (DE) | 1991-03-06 | — | — | EP | disclosed |