Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.48 |
| ▸ | HHAT | Q5VTY9 | 3/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9508177 | 0.90 | ACE (0.49) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL2138396 | 0.82 | DRD1 (0.59) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL9508502 | 0.79 | MTNR1B (0.57) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL9509872 | 0.78 | MTNR1B (0.53) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL9511054 | 0.78 | ACE (0.45) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL9508456 | 0.77 | HHAT (0.57) | HHATCYP2D6TRPM8 | |
| SCHEMBL9508473 | 0.77 | TRPM8 (0.45) | ACEMTNR1BDRD1TRPM8NPSR1 | |
| SCHEMBL9509163 | 0.76 | MTNR1B (0.51) | ACEHHATMTNR1BDRD1NPSR1 | |
| SCHEMBL9508172 | 0.75 | DRD1 (0.57) | ACEHHATMTNR1BDRD1CYP2D6 | |
| SCHEMBL30878505 | 0.74 | ACE (0.52) | ACEHHATMTNR1BDRD1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0230871-A2 | Haloacyl 1-substituted-1,2,3,4-tetrahydroisoquinolines as herbicide antidotes | Monsanto Company (US) | 1987-08-05 | — | — | EP | claimed |