Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 1/20 | 0.53 |
| ▸ | DRD5 | P21918 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 13/20 | 0.52 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8187878 | 1.00 | DRD1 (0.53) | DRD1DRD5HRH3MAOBMAOA | |
| SCHEMBL8185098 | 0.99 | DRD1 (0.55) | DRD1DRD5HRH3 | |
| SCHEMBL8185368 | 0.94 | DRD1 (0.56) | DRD1DRD5HRH3 | |
| SCHEMBL8177232 | 0.88 | HRH3 (0.55) | DRD1DRD5HRH3 | |
| SCHEMBL8176556 | 0.86 | HRH3 (0.59) | DRD1DRD5HRH3 | |
| SCHEMBL8185363 | 0.85 | HRH3 (0.64) | DRD1DRD5HRH3MAOBMAOA | |
| SCHEMBL8184946 | 0.83 | DRD1 (0.50) | DRD1DRD5HRH3 | |
| SCHEMBL8176140 | 0.83 | DRD1 (0.58) | DRD1DRD5HRH3MAOBMAOA | |
| SCHEMBL17899737 | 0.82 | HRH3 (0.49) | HRH3 | |
| SCHEMBL5503627 | 0.82 | HRH3 (0.54) | DRD1DRD5HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6096752-A | Method for the preparation of tertiary amines, a compound useful therefor and alpha-2-receptor active tetrahydroisoquinoline derivatives | HEINONEN PETRI (FI) | 2000-08-01 | — | — | US | disclosed |
| US-5912342-A | SYNTHESIS OF COMBINATORIAL LIBRARIES BY COMPUTER CONTROLLED ROBOT | HEINONEN PETRI (FI) | 1999-06-15 | — | — | US | disclosed |