Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL24571656 | 0.83 | CA1 (0.42) | CA1CA12CA2CA14 | |
| SCHEMBL13108947 | 0.81 | — | — | |
| SCHEMBL14628697 | 0.80 | CA1 (0.48) | CA1CA12CA2CA14 | |
| SCHEMBL9888838 | 0.79 | CA1 (0.32) | CA1CA12CA2CA14 | |
| SCHEMBL18923068 | 0.74 | CA1 (0.34) | CA1CA12CA2CA14 | |
| SCHEMBL25523045 | 0.72 | CYP1A2 (0.34) | — | |
| SCHEMBL15629145 | 0.72 | TP53 (0.34) | — | |
| SCHEMBL17030325 | 0.71 | — | — | |
| SCHEMBL10312292 | 0.70 | — | — | |
| SCHEMBL22736236 | 0.69 | CA1 (0.30) | CA1 |
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-7160886-B2 | Acylated piperazine derivatives as melanocortin-4 receptor agonists | MERCK & CO., INC. (US) | 2007-01-09 | — | — | US | disclosed |