Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 4/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27463785 | 0.99 | HSD11B1 (0.51) | HSD11B1DRD2CHRNB4CHRNA3DDB1 | |
| Cadaverine Tartrate SCHEMBL8034056 | 0.76 | HSD11B1 (0.48) | HSD11B1DRD2DDB1CRBN | |
| SCHEMBL7103180 | 0.74 | HSD11B1 (0.68) | HSD11B1DRD2DDB1CRBNHTR2C | |
| SCHEMBL13162095 | 0.69 | CHRNB4 (0.62) | DRD2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL13452591 | 0.68 | CHRNA7 (0.56) | DRD2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL28829972 | 0.67 | KDM1A (0.60) | HSD11B1DRD2DDB1CRBNHTR2C | |
| SCHEMBL14613763 | 0.67 | HTR2C (0.64) | DRD2DDB1CRBNHTR2CHTR2A | |
| SCHEMBL4404670 | 0.67 | DRD2 (0.71) | DRD2HTR2CGID4 | |
| SCHEMBL13452486 | 0.67 | CHRNA7 (0.54) | DRD2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL27881141 | 0.67 | DRD2 (0.48) | DRD2CHRNB4CHRNA3HTR2CCHRNA7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6140502-A | Heat-based process for the re-racemisation of a (-)-2-phenylmethyl-3,3-dimethyl-piperidin-4-on derivative | BOEHRINGER INGELHEIM KG (DE) | 2000-10-31 | — | — | US | disclosed |
| US-6136980-A | Method of preparing norbenzomorphane as an intermediate in the preparation of pharmaceutically useful benzomorphane derivatives, in particular (-)-(1R,5S,2\"R)-3'-hydroxy-2-(2-methoxypropyl)-5,9,9-trimethyl-6,7-benzo morphane | BOEHRINGER INGELHEIM KG (DE) | 2000-10-24 | — | — | US | disclosed |
| US-6054604-A | Method of preparing norbenzomorphane as an intermediate | BOEHRINGER INGELHEIM KG (DE) | 2000-04-25 | — | — | US | disclosed |
| US-5945535-A | Method of preparing norbenzomorphanes | BOEHRINGER INGELHEIM KG (DE) | 1999-08-31 | — | — | US | disclosed |