Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 5/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24224451 | 0.74 | SLC6A4 (0.49) | SLC6A4SIGMAR1TMEM97SLC6A3GRIN1 | |
| SCHEMBL18460931 | 0.74 | GRIN1 (0.49) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL24224567 | 0.68 | SLC6A4 (0.40) | SLC6A4SIGMAR1TMEM97SLC6A3 | |
| SCHEMBL10162816 | 0.67 | SIGMAR1 (1.00) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL10163317 | 0.67 | SIGMAR1 (1.00) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL17667804 | 0.67 | SIGMAR1 (1.00) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL17773741 | 0.67 | SIGMAR1 (1.00) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL24224548 | 0.66 | SIGMAR1 (0.71) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL10163270 | 0.65 | SIGMAR1 (0.86) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A | |
| SCHEMBL10162806 | 0.65 | SIGMAR1 (0.86) | SLC6A4SIGMAR1TMEM97GRIN1GRIN2A |
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-3603674-A1 | COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF INTRACTABLE AND CHRONIC PAIN | CONCERT PHARMACEUTICALS, INC. (US) | 2020-02-05 | — | — | EP | disclosed |