Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9682670 | 0.71 | ALDH1A1 (0.43) | GRIN1GRIN2AGRIN2BHSD11B1OPRM1 | |
| SCHEMBL31221485 | 0.71 | OPRM1 (0.55) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL765328 | 0.71 | OPRM1 (0.55) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL4064144 | 0.71 | OPRM1 (0.55) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL30372106 | 0.70 | OPRM1 (0.51) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL745035 | 0.70 | OPRM1 (0.51) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL9683265 | 0.69 | GRIN1 (0.39) | GRIN1GRIN2AGRIN2BHSD11B1OPRM1 | |
| SCHEMBL30731373 | 0.69 | GRIN1 (0.45) | GRIN1GRIN2AGRIN2BHSD11B1GAA | |
| SCHEMBL536677 | 0.68 | OPRM1 (0.57) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 | |
| SCHEMBL29980665 | 0.68 | OPRM1 (0.57) | GRIN1GRIN2AGRIN2BHSD11B1CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6248913-B1 | MOLYBDENUM COMPOUNDS WITH BIDENTATE, CYCLICALLY SUBSTITUTED LIGANDS GIVE EXCELLENT YIELDS AND SELECTIVITIES | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) | 2001-06-19 | — | — | US | disclosed |