Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 2/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.53 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.53 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11540615 | 0.90 | OPRK1 (0.51) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11540165 | 0.89 | OPRK1 (0.49) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11539915 | 0.88 | OPRK1 (0.53) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL7307602 | 0.88 | OPRK1 (0.48) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11538983 | 0.88 | TDP1 (0.55) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11539241 | 0.87 | GABRA1 (0.53) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11542331 | 0.80 | OPRK1 (0.53) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL7308410 | 0.80 | OPRK1 (0.56) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL1313752 | 0.80 | GABRA1 (0.60) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL7314894 | 0.80 | GABRA1 (0.60) | OPRK1PDE4DGABRA1GABRG2GABRB3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4166185-A | ANTICONVULSANTS, ANXIOLYTICS, SEDATIVES, MUSCLE RELAXANTS | HOFFMANN-LA ROCHE INC. (US) | 1979-08-28 | — | — | US | disclosed |
| US-4147875-A | ANTIDEPRESSANTS, ANTICONBULSANTS, MUSCLE RELAXANTS | HOFFMANN-LA ROCHE INC. (US) | 1979-04-03 | — | — | US | disclosed |
| US-4146722-A | SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS | HOFFMANN-LA ROCHE INC. (US) | 1979-03-27 | — | — | US | disclosed |