Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.45 |
| ▸ | FAAH | O00519 | 14/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11224620 | 0.76 | DRD2 (0.53) | CYP19A1 | |
| SCHEMBL13866813 | 0.71 | DRD2 (0.50) | — | |
| SCHEMBL346240 | 0.70 | FAAH (0.61) | CYP19A1FAAH | |
| SCHEMBL346899 | 0.70 | FAAH (0.54) | FAAH | |
| SCHEMBL346830 | 0.70 | FAAH (0.49) | FAAH | |
| SCHEMBL4045668 | 0.69 | MAOA (0.52) | FAAH | |
| SCHEMBL13241438 | 0.67 | ACHE (0.44) | — | |
| SCHEMBL13866811 | 0.67 | DRD2 (0.49) | CYP19A1CYP11B2 | |
| SCHEMBL4045125 | 0.67 | PSEN1 (0.42) | — | |
| SCHEMBL1025843 | 0.67 | DRD2 (0.49) | CYP19A1CYP11B2 |
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-1268412-B1 | SULPHONAMIDO-SUBSTITUTED BRIDGED BICYCLOALKYL DERIVATIVES | MERCK SHARP & DOHME (GB) | 2006-11-22 | — | — | EP | disclosed |