Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 19/20 | 0.79 |
| ▸ | IDH2 | P48735 | 3/20 | 0.50 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21378385 | 0.88 | IDH1 (1.00) | IDH1IDH2 | |
| SCHEMBL19700788 | 0.88 | IDH1 (1.00) | IDH1IDH2 | |
| SCHEMBL22201738 | 0.85 | IDH1 (0.58) | IDH1 | |
| SCHEMBL22201530 | 0.83 | IDH1 (0.56) | IDH1IDH2JAK3 | |
| SCHEMBL22201588 | 0.83 | IDH1 (0.79) | IDH1IDH2 | |
| SCHEMBL19191762 | 0.80 | IDH1 (0.68) | IDH1 | |
| SCHEMBL21378545 | 0.79 | IDH1 (0.84) | IDH1IDH2 | |
| SCHEMBL21378543 | 0.79 | IDH1 (0.84) | IDH1IDH2 | |
| SCHEMBL20289767 | 0.77 | IDH1 (0.63) | IDH1IDH2 | |
| SCHEMBL19692697 | 0.76 | IDH1 (0.76) | IDH1IDH2 |
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-3464281-B1 | MUTANT IDH1 INHIBITORS | LILLY CO ELI (US) | 2020-07-08 | — | — | EP | disclosed |