Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 7/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL279838 | 0.85 | POLB (0.51) | F10DRD2DRD3IKBKBRAB9A | |
| SCHEMBL20618506 | 0.79 | HDAC3 (0.58) | F10MAPK1HDAC3HDAC4HDAC1 | |
| SCHEMBL20615680 | 0.78 | HDAC3 (0.52) | F10MAPK1HDAC3HDAC4HDAC1 | |
| SCHEMBL8258082 | 0.76 | HDAC3 (0.47) | F10MAPK1HDAC3HDAC4HDAC1 | |
| SCHEMBL5088410 | 0.73 | ADRB1 (0.60) | HDAC4HDAC6HPGDIKBKBSCN9A | |
| SCHEMBL31188482 | 0.73 | ADRB1 (0.60) | HDAC4HDAC6HPGDIKBKBSCN9A | |
| SCHEMBL8274391 | 0.73 | ADRB1 (0.60) | HDAC4HDAC6HPGDIKBKBSCN9A | |
| SCHEMBL946532 | 0.73 | F10 (0.59) | F10MAPK1HPGDTSHRF2 | |
| SCHEMBL76883 | 0.73 | F10 (0.59) | F10MAPK1HPGDTSHRF2 | |
| SCHEMBL20344016 | 0.73 | SCN9A (0.58) | HDAC4HDAC6IKBKBSCN9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7820699-B2 | Cyclic amines | HOFFMANN-LA ROCHE INC. (US) | 2010-10-26 | — | — | US | disclosed |
| US-7820699-B2 | Cyclic amines | HOFFMANN-LA ROCHE INC. (US) | 2010-10-26 | — | — | US | disclosed |
| WO-2006114401-A2 | NOVEL CYCLIC AMINES | F. HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | WO | disclosed |