Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 17/20 | 0.47 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21399946 | 0.88 | IDH1 (0.61) | IDH1 | |
| SCHEMBL22201785 | 0.86 | IDH1 (0.61) | IDH1 | |
| SCHEMBL22201621 | 0.85 | IDH1 (0.65) | IDH1 | |
| SCHEMBL22201523 | 0.85 | IDH1 (0.63) | IDH1 | |
| SCHEMBL22201791 | 0.83 | IDH1 (0.49) | IDH1 | |
| SCHEMBL19692699 | 0.80 | IDH1 (0.58) | IDH1 | |
| SCHEMBL22201733 | 0.80 | IDH1 (0.40) | IDH1PDE1APDE1BPDE1CCA1 | |
| SCHEMBL22201529 | 0.79 | IDH1 (0.57) | IDH1CA1CA2CA9 | |
| SCHEMBL21378519 | 0.76 | IDH1 (0.77) | IDH1 | |
| SCHEMBL21378518 | 0.76 | IDH1 (0.77) | 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 |