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 | |
|---|---|---|---|---|
| SCHEMBL19621048 | 0.83 | GABRA1 (0.34) | GABRA1GABRB1 | |
| SCHEMBL2587254 | 0.77 | AKR1C3 (0.36) | — | |
| SCHEMBL35210764 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL35211202 | 0.71 | MAP2K1 (0.35) | — | |
| SCHEMBL19621030 | 0.70 | GABRA1 (0.31) | GABRA1GABRB1 | |
| SCHEMBL18676860 | 0.69 | GABRA1 (0.35) | GABRA1GABRB1 | |
| SCHEMBL35210704 | 0.68 | NOTUM (0.37) | — | |
| SCHEMBL35211188 | 0.68 | MAP2K1 (0.39) | — | |
| SCHEMBL35210669 | 0.67 | PTPN11 (0.38) | — | |
| SCHEMBL2594981 | 0.63 | MYC (0.37) | — |
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-3246027-A1 | INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER | GlaxoSmithKline LLC (US) | 2017-11-22 | — | — | EP | disclosed |