Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 6/20 | 0.35 |
| ▸ | DRD4 | P21917 | 6/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11574266 | 0.86 | MAPK1 (0.54) | HRH4MAPK1SMN1; SMN2DRD2DRD4 | |
| SCHEMBL11575421 | 0.84 | SMN1; SMN2 (0.54) | HRH4MAPK1SMN1; SMN2DRD2DRD4 | |
| SCHEMBL11574683 | 0.78 | RAD52 (0.47) | HRH4MAPK1SMN1; SMN2DRD2DRD4 | |
| SCHEMBL11574348 | 0.75 | MAPK1 (0.59) | MAPK1SMN1; SMN2MAP3K14DRD2DRD4 | |
| SCHEMBL11573321 | 0.72 | MAPK1 (0.54) | MAPK1SMN1; SMN2DRD2DRD4HTR2B | |
| SCHEMBL11574851 | 0.72 | SMN1; SMN2 (0.54) | MAPK1SMN1; SMN2DRD2DRD4CYP1A2 | |
| SCHEMBL11574443 | 0.71 | MAPK1 (0.46) | MAPK1SMN1; SMN2DRD2TP53MAPT | |
| SCHEMBL11577080 | 0.70 | SMN1; SMN2 (0.55) | MAPK1SMN1; SMN2MAP3K14DRD2DRD4 | |
| SCHEMBL10409949 | 0.70 | MAPK1 (0.79) | MAPK1SMN1; SMN2DRD2HTR2BL3MBTL1 | |
| SCHEMBL11575959 | 0.70 | MAPK1 (0.51) | MAPK1SMN1; SMN2DRD2DRD4L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4086350-A | FLUORO, CHLORO AND CYANO SUBSTITUTED 4-(9-XANTHENYLIDENE, 9-THIOXANTHENYLIDENE OR 11(6H)-DIBENZO(B,E)OXEPINYLIDENE)-1-METHYL-PIPERIDINES | SMITHKLINE CORPORATION (US) | 1978-04-25 | — | — | US | disclosed |