Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 1/20 | 0.75 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | BCHE | P06276 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7700175 | 1.00 | SLC6A9 (0.75) | SLC6A9GRIN2BGRIN1NPY5RACHE | |
| SCHEMBL7703437 | 0.89 | SLC6A9 (0.60) | SLC6A9GRIN2BGRIN1ACHEBCHE | |
| SCHEMBL7701273 | 0.89 | SLC6A9 (0.60) | SLC6A9GRIN2BGRIN1ACHEBCHE | |
| Org-25935 SCHEMBL27034881 | 0.86 | SLC6A9 (1.00) | SLC6A9GRIN2BGRIN1CA1CA2 | |
| Org-25935 SCHEMBL7703430 | 0.86 | SLC6A9 (1.00) | SLC6A9GRIN2BGRIN1CA1CA2 | |
| Org-25935 SCHEMBL1761267 | 0.86 | SLC6A9 (1.00) | SLC6A9GRIN2BGRIN1CA1CA2 | |
| Org-25935 SCHEMBL7703262 | 0.85 | SLC6A9 (0.98) | SLC6A9GRIN2BGRIN1CA1CA2 | |
| Hydrochloric Acid SCHEMBL7698457 | 0.84 | SLC6A9 (0.77) | SLC6A9GRIN2BGRIN1NPY5R | |
| SCHEMBL7703310 | 0.84 | SLC6A9 (0.56) | SLC6A9 | |
| SCHEMBL7700451 | 0.84 | SLC6A9 (0.53) | SLC6A9 |
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-1100769-B1 | AMINOMETHYLCARBOXYLIC ACID DERIVATIVES | AKZO NOBEL NV (NL) | 2002-12-04 | — | — | EP | disclosed |