Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 4/20 | 0.57 |
| ▸ | ACE | P12821 | 2/20 | 0.49 |
| ▸ | HHAT | Q5VTY9 | 3/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 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 | |
|---|---|---|---|---|
| SCHEMBL9509872 | 0.87 | MTNR1B (0.53) | MTNR1BACEHHATDRD1CYP2D6 | |
| SCHEMBL9509163 | 0.85 | MTNR1B (0.51) | MTNR1BACEHHATDRD1NPSR1 | |
| SCHEMBL9508177 | 0.80 | ACE (0.49) | MTNR1BACEHHATDRD1CYP2D6 | |
| SCHEMBL2138396 | 0.80 | DRD1 (0.59) | MTNR1BACEHHATDRD1CYP2D6 | |
| SCHEMBL10770517 | 0.79 | ACE (0.48) | MTNR1BACEHHATDRD1CYP2D6 | |
| SCHEMBL9511054 | 0.76 | ACE (0.45) | MTNR1BACEHHATDRD1CYP2D6 | |
| SCHEMBL19010155 | 0.75 | PRCP (0.51) | MTNR1BDRD1OPRM1OPRD1 | |
| SCHEMBL19010161 | 0.75 | PRCP (0.51) | MTNR1BDRD1OPRM1OPRD1 | |
| SCHEMBL19010148 | 0.75 | PRCP (0.51) | MTNR1BDRD1OPRM1OPRD1 | |
| SCHEMBL9508456 | 0.75 | HHAT (0.57) | HHATCYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0230871-B1 | HALOACYL 1-SUBSTITUTED-1,2,3,4-TETRAHYDROISOQUINOLINES AS HERBICIDE ANTIDOTES | Monsanto Company (US) | 1993-09-22 | — | — | EP | claimed |
| EP-0230871-A2 | Haloacyl 1-substituted-1,2,3,4-tetrahydroisoquinolines as herbicide antidotes | Monsanto Company (US) | 1987-08-05 | — | — | EP | claimed |
| EP-0230871-B1 | HALOACYL 1-SUBSTITUTED-1,2,3,4-TETRAHYDROISOQUINOLINES AS HERBICIDE ANTIDOTES | Monsanto Company (US) | 1993-09-22 | — | — | EP | disclosed |
| US-4755218-A | Reducing acetochlor injury to corn by applying with antidote | MONSANTO COMPANY (US) | 1988-07-05 | — | — | US | disclosed |
| EP-0230871-A2 | Haloacyl 1-substituted-1,2,3,4-tetrahydroisoquinolines as herbicide antidotes | Monsanto Company (US) | 1987-08-05 | — | — | EP | disclosed |