Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12813382 | 0.88 | HSD11B1 (0.34) | CYP3A4KCNH2 | |
| SCHEMBL12813408 | 0.87 | C5AR1 (0.33) | SLC6A4SLC6A3SLC6A2CYP3A4 | |
| SCHEMBL12813412 | 0.85 | SLC6A2 (0.35) | SLC6A4SLC6A2 | |
| SCHEMBL12813191 | 0.81 | KMT2A (0.33) | SLC6A2 | |
| SCHEMBL12813495 | 0.80 | CYP3A4 (0.39) | CYP3A4PTGS2 | |
| SCHEMBL12813698 | 0.80 | RXRA (0.33) | — | |
| SCHEMBL12813325 | 0.80 | CES2 (0.32) | — | |
| SCHEMBL16499126 | 0.79 | CYP11B1 (0.36) | — | |
| SCHEMBL12813356 | 0.79 | TSHR (0.41) | SLC6A4SLC6A2CYP2D6 | |
| SCHEMBL12813364 | 0.78 | ALDH1A1 (0.34) | SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012134971-A2 | OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE | BIKAM PHARMACEUTICALS, INC. (US) | 2012-10-04 | — | — | WO | disclosed |
| WO-2011155983-A1 | OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE | BIKAM PHARMACEUTICALS INC. (US) | 2011-12-15 | — | — | WO | disclosed |