Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 19/20 | 0.57 |
| ▸ | IDH2 | P48735 | 3/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21400141 | 0.86 | IDH1 (0.77) | IDH1IDH2 | |
| SCHEMBL22201803 | 0.86 | IDH1 (0.56) | IDH1IDH2 | |
| SCHEMBL21399961 | 0.86 | IDH1 (0.73) | IDH1IDH2 | |
| SCHEMBL19700736 | 0.84 | ACHE (0.47) | IDH1 | |
| SCHEMBL22201753 | 0.84 | IDH1 (0.81) | IDH1IDH2 | |
| SCHEMBL22201530 | 0.83 | IDH1 (0.56) | IDH1IDH2JAK3 | |
| SCHEMBL19700706 | 0.83 | IDH1 (0.54) | IDH1 | |
| SCHEMBL22201619 | 0.82 | IDH1 (0.78) | IDH1 | |
| SCHEMBL19700750 | 0.82 | IDH1 (0.66) | IDH1IDH2 | |
| SCHEMBL22201752 | 0.81 | IDH1 (0.79) | IDH1 |
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-3464281-B1 | MUTANT IDH1 INHIBITORS | LILLY CO ELI (US) | 2020-07-08 | — | — | EP | disclosed |
| WO-2017213910-A1 | MUTANT IDH1 INHIBITORS | ELI LILLY AND COMPANY (US) | 2017-12-14 | — | — | WO | disclosed |