Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | BUB1 | O43683 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7589611 | 0.94 | HCRTR1 (0.34) | HCRTR1HCRTR2BUB1 | |
| SCHEMBL8415099 | 0.82 | HCRTR1 (0.33) | HCRTR1HCRTR2 | |
| SCHEMBL7594696 | 0.78 | HCRTR1 (0.31) | HCRTR1HCRTR2 | |
| SCHEMBL8378111 | 0.73 | HCRTR1 (0.32) | HCRTR1HCRTR2BUB1 | |
| SCHEMBL8415098 | 0.73 | — | — | |
| SCHEMBL8416621 | 0.70 | HDAC3 (0.31) | — | |
| SCHEMBL7595392 | 0.69 | — | — | |
| SCHEMBL7592876 | 0.69 | HSD17B10 (0.38) | — | |
| SCHEMBL7595402 | 0.65 | ALDH1A1 (0.31) | — | |
| SCHEMBL7592583 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0782564-B1 | IODINATED X-RAY CONTRAST MEDIA | NYCOMED IMAGING AS (NO) | 1999-09-01 | — | — | EP | disclosed |