Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL397456 | 0.95 | — | — | |
| SCHEMBL3678383 | 0.79 | — | — | |
| SCHEMBL620412 | 0.76 | CA1 (0.36) | ALDH1A1 | |
| SCHEMBL24091774 | 0.74 | — | — | |
| SCHEMBL1412968 | 0.72 | — | — | |
| SCHEMBL17992598 | 0.71 | CES2 (0.44) | — | |
| SCHEMBL5250933 | 0.71 | — | — | |
| SCHEMBL1667685 | 0.71 | CES2 (0.39) | TSHR | |
| SCHEMBL18751717 | 0.69 | CES2 (0.48) | TSHR | |
| SCHEMBL9973392 | 0.69 | CES2 (0.48) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1773816-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2007-04-18 | — | — | EP | disclosed |
| WO-2006002421-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-01-05 | — | — | WO | disclosed |