Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.30 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL6078731 | 0.94 | CLK1 (0.31) | HCRTR1HCRTR2 | |
| SCHEMBL31467456 | 0.86 | TERT (0.31) | HCRTR1HCRTR2 | |
| SCHEMBL3576265 | 0.84 | HCAR2 (0.42) | HCAR2BCL2MDM2MCL1 | |
| SCHEMBL6079255 | 0.79 | AURKA (0.33) | — | |
| SCHEMBL1091718 | 0.75 | BAZ2B (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL6442036 | 0.75 | HCAR2 (0.45) | HCAR2 | |
| SCHEMBL31467472 | 0.74 | BAZ2B (0.34) | — | |
| SCHEMBL16468319 | 0.74 | SLC6A3 (0.35) | — | |
| SCHEMBL31459277 | 0.73 | BAZ2B (0.33) | — | |
| SCHEMBL12985115 | 0.73 | HCAR2 (0.47) | HCAR2 |
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-5612477-A | 2-(pyrazol-3-yl)carbapenem derivatives | SMITHKLINE BEECHAM P.L.C | 1997-03-18 | — | — | US | disclosed |