Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | CACNA1H | O95180 | 8/20 | 0.41 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20141383 | 0.84 | TRPA1 (0.52) | TRPA1CACNA1HEGLN2AAK1DAO | |
| SCHEMBL7673651 | 0.80 | CACNA1H (0.45) | TRPA1CACNA1HEGLN2MAPTTDP1 | |
| SCHEMBL6928939 | 0.78 | TRPA1 (0.54) | TRPA1CACNA1HEGLN2NSD2CTSS | |
| SCHEMBL6432281 | 0.78 | DAO (0.42) | CACNA1HDAO | |
| Bromide SCHEMBL6409244 | 0.77 | DAO (0.42) | CACNA1HDAO | |
| SCHEMBL27549593 | 0.77 | TRPA1 (0.47) | TRPA1CACNA1HEGLN2CTSSCTSK | |
| SCHEMBL7183733 | 0.77 | CYP11B1 (0.46) | TRPA1CACNA1HEGLN2 | |
| SCHEMBL6433917 | 0.77 | DAO (0.46) | CACNA1HDAO | |
| SCHEMBL28963038 | 0.76 | CA12 (0.43) | TRPA1CACNA1HEGLN2CTSSCTSK | |
| SCHEMBL7743907 | 0.75 | DAO (0.47) | NSD2DAO |
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-2001017992-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |