Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 1/20 | 0.60 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.51 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | ACE | P12821 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | LIPE | Q05469 | 1/20 | 0.46 |
| ▸ | HHAT | Q5VTY9 | 2/20 | 0.45 |
| ▸ | PRCP | P42785 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SPR | P35270 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30878500 | 1.00 | DRD1 (0.60) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL18711615 | 0.87 | DRD1 (0.60) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL10312392 | 0.87 | DRD1 (0.60) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL17061165 | 0.83 | ACE (0.51) | DRD1MTNR1BACEHHATPRCP | |
| SCHEMBL24926029 | 0.83 | DRD1 (0.67) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL18701598 | 0.83 | DRD1 (0.56) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL18701662 | 0.83 | DRD1 (0.56) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL18711700 | 0.83 | DRD1 (0.67) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL18701717 | 0.83 | DRD1 (0.56) | DRD1MTNR1BRIPK1AKR1C3ACE | |
| SCHEMBL23327029 | 0.82 | NPC1 (0.68) | DRD1NPC1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019200120-A1 | DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS | LYCERA CORPORATION (US) | 2019-10-17 | — | — | WO | disclosed |