Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.49 |
| ▸ | CCKAR | P32238 | 7/20 | 0.47 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.47 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.47 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13352411 | 0.88 | CCKAR (0.48) | PTGS2PTGS1CCKARKCNJ6KCNJ3 | |
| SCHEMBL3096791 | 0.88 | MEN1 (0.48) | PTGS2PTGS1CCKARCYP1A2CYP3A4 | |
| SCHEMBL14714593 | 0.87 | CCKAR (0.48) | PTGS2PTGS1CCKAR | |
| SCHEMBL13993264 | 0.84 | PTGS2 (0.46) | PTGS2PTGS1CCKARCYP1A2CYP3A4 | |
| SCHEMBL14504449 | 0.83 | MGLL (0.52) | PTGS2PTGS1KCNJ6KCNJ5KCNJ3 | |
| SCHEMBL3100346 | 0.83 | MEN1 (0.52) | PTGS2PTGS1KCNJ6KCNJ3CYP1A2 | |
| SCHEMBL3104741 | 0.81 | CCKAR (0.47) | PTGS2CCKAR | |
| SCHEMBL13157986 | 0.80 | CCKAR (0.48) | CCKAR | |
| SCHEMBL13157959 | 0.80 | CCKAR (0.48) | CCKAR | |
| SCHEMBL14504928 | 0.79 | PTGS2 (0.47) | PTGS2PTGS1CCKARKCNJ6KCNJ3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103002893-A | Therapeutic agent or prophylactic agent for neuropathic pain | TORAY INDUSTRIES | 2013-03-27 | — | — | CN | disclosed |