Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | PPIB | P23284 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 6/20 | 0.40 |
| ▸ | DRD4 | P21917 | 5/20 | 0.40 |
| ▸ | HRH1 | P35367 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | BACE1 | P56817 | 5/20 | 0.40 |
| ▸ | CTSD | P07339 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | DRD5 | P21918 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11243297 | 0.92 | PPIB (0.45) | PPIBDRD2DRD4HTR2ABACE1 | |
| SCHEMBL11246209 | 0.83 | HRH1 (0.40) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| SCHEMBL11248897 | 0.82 | HRH1 (0.56) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| Bromide SCHEMBL11473841 | 0.81 | HRH1 (0.56) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| SCHEMBL11245536 | 0.81 | HRH1 (0.42) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| SCHEMBL11435472 | 0.80 | SLC6A2 (0.42) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| SCHEMBL7681805 | 0.79 | HRH4 (0.45) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| Hydrochloric Acid SCHEMBL11400430 | 0.78 | HRH4 (0.44) | SLC6A2SLC6A4SLC6A3DRD2DRD4 | |
| SCHEMBL11257464 | 0.77 | MAPK14 (0.41) | PPIBDRD2DRD4BACE1CTSD | |
| SCHEMBL11242210 | 0.77 | HRH1 (0.41) | SLC6A2SLC6A4SLC6A3DRD2DRD4 |
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-0016261-B1 | SPIRO(DIBENZ(B,F)OXEPIN-PIPERIDINES) AND METHODS OF PREPARING SAME | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-12-29 | — | — | EP | disclosed |
| US-4198418-A | ANALGESICS, TRANQUILIZERS, ANTICONVULSANTS | AMERICAN HOECHST CORPORATION (US) | 1980-04-15 | — | — | US | disclosed |