Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9737862 | 0.93 | TSPO (0.52) | TSPOGMNNLMNAPOLBCYP3A4 | |
| SCHEMBL9737796 | 0.92 | GABRA2 (0.47) | — | |
| SCHEMBL9737572 | 0.88 | TSPO (0.45) | TSPOHTR1BHTR2BLMNACYP3A4 | |
| SCHEMBL9737163 | 0.84 | ALDH1A1 (0.43) | LMNANPSR1 | |
| SCHEMBL9737283 | 0.84 | PTGDR2 (0.47) | LMNAPOLB | |
| SCHEMBL18116342 | 0.83 | HTR1B (0.44) | TSPOHTR1BHTR2BLMNA | |
| SCHEMBL9737491 | 0.83 | PTGS2 (0.41) | NPSR1 | |
| SCHEMBL9737185 | 0.81 | KCNQ3 (0.41) | — | |
| SCHEMBL9737961 | 0.79 | ALDH1A1 (0.43) | TSPO | |
| SCHEMBL9738747 | 0.78 | ALDH1A1 (0.45) | TSPO |
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 |
|---|---|---|---|---|---|---|---|
| US-5114944-A | Anxiolytic and anticonvulsant agents; muscle relaxants | A. H. ROBINS COMPANY INCORPORATED (US) | 1992-05-19 | — | — | US | claimed |
| US-5114944-A | Anxiolytic and anticonvulsant agents; muscle relaxants | A. H. ROBINS COMPANY INCORPORATED (US) | 1992-05-19 | — | — | US | disclosed |