Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 1/20 | 0.47 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.47 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.47 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.47 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27371469 | 0.84 | GRIA1 (0.42) | GRIA1GRIA2GRIA3GRIA4SLC9A1 | |
| SCHEMBL9700422 | 0.77 | GRIA1 (0.41) | GRIA1GRIA2GRIA3GRIA4L3MBTL1 | |
| SCHEMBL2884919 | 0.75 | GRIA1 (0.56) | GRIA1GRIA2GRIA3GRIA4ALDH1A1 | |
| SCHEMBL9698072 | 0.75 | GRIA1 (0.40) | GRIA1GRIA2GRIA3GRIA4ALDH1A1 | |
| SCHEMBL18128766 | 0.73 | GRIA1 (0.54) | GRIA1GRIA2GRIA3GRIA4ALDH1A1 | |
| SCHEMBL4444489 | 0.71 | ALDH1A1 (0.42) | L3MBTL1ALDH1A1TSHRERN1 | |
| SCHEMBL20083904 | 0.71 | ERN1 (0.44) | ALDH1A1SMN1; SMN2TSHRERN1 | |
| SCHEMBL15814013 | 0.71 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2TSHRERN1 | |
| SCHEMBL97117 | 0.71 | GRIA1 (0.52) | GRIA1GRIA2GRIA3GRIA4ALDH1A1 | |
| SCHEMBL3687015 | 0.71 | GRIA1 (0.52) | GRIA1GRIA2GRIA3GRIA4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1098866-B1 | METHOD FOR PRODUCING ORTHO-ALKYLATED BENZOIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2004-02-11 | — | — | EP | claimed |
| WO-2017137147-A1 | CRYSTALLINE MODIFICATIONS OF N-(4,5-BISMETHANESULFONYL-2-METHYLBENZOYL)GUANIDINE HYDROCHLORIDE AND N-(4,5-BISMETHANESULFONYL-2-METHYLBENZOYL)GUANIDINE SALTS | MERCK PATENT GMBH (DE) | 2017-08-17 | — | — | WO | disclosed |