Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4225392 | 0.84 | HTT (0.40) | HTTCES1SMN1; SMN2OPRM1OPRD1 | |
| SCHEMBL8469874 | 0.77 | AKR1C1 (0.35) | AKR1C1LMNAHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL28568646 | 0.76 | HSD11B1 (0.35) | AKR1C1LMNAHTT | |
| SCHEMBL9142790 | 0.76 | HSD11B1 (0.35) | AKR1C1LMNAHTT | |
| SCHEMBL17707789 | 0.74 | AKR1C1 (0.33) | AKR1C1LMNAHTT | |
| SCHEMBL27621152 | 0.73 | LMNA (0.33) | AKR1C1LMNAHTTSMN1; SMN2 | |
| SCHEMBL20378032 | 0.68 | ALDH1A1 (0.33) | LMNAHTTSMN1; SMN2OPRM1 | |
| SCHEMBL2274804 | 0.67 | NPC1 (0.41) | LMNASMN1; SMN2 | |
| SCHEMBL8930987 | 0.66 | CA2 (0.32) | — | |
| SCHEMBL2276486 | 0.65 | RORC (0.33) | HTTSMN1; SMN2 |
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-2010020548-A1 | GLYT1 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-25 | — | — | WO | disclosed |