Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 6/20 | 0.33 |
| ▸ | MAOB | P27338 | 5/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4872282 | 0.84 | HRH1 (0.48) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL14197429 | 0.76 | HRH1 (0.52) | HRH1DRD2HDAC6 | |
| SCHEMBL4862162 | 0.76 | HRH1 (0.49) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL11359103 | 0.76 | HRH1 (0.58) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL27629337 | 0.73 | HRH1 (0.59) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL27649837 | 0.73 | HRH1 (0.59) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL14197457 | 0.73 | HRH1 (0.49) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL4863503 | 0.73 | HRH1 (0.49) | HRH1JAK3DRD2DRD4HDAC6 | |
| SCHEMBL12938774 | 0.69 | SRD5A1 (0.45) | HRH1JAK3HDAC6CREBBPHTR6 | |
| SCHEMBL15478089 | 0.69 | HRH1 (0.41) | HRH1JAK3DRD2DRD4CREBBP |
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-7351839-B2 | Process for the preparation of 1,2,3,4,8,9,10, 10a-octahydro-7bH-cyclopenta[b][1,4]diazepino-[6,7,1-hi]indole derivatives | WYETH (US) | 2008-04-01 | — | — | US | disclosed |