Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 12/20 | 0.60 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | VEGFA | P15692 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 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 | |
|---|---|---|---|---|
| SCHEMBL19700763 | 0.89 | IDH1 (0.78) | IDH1 | |
| SCHEMBL22201583 | 0.87 | IDH1 (0.54) | IDH1DNMT3AADORA2BACHE | |
| SCHEMBL22201588 | 0.86 | IDH1 (0.79) | IDH1 | |
| SCHEMBL19701040 | 0.84 | IDH1 (0.66) | IDH1DNMT3AADORA2B | |
| SCHEMBL19700697 | 0.84 | DNMT3A (0.54) | DNMT3AIDO1TDO2IDO2GPR119 | |
| SCHEMBL22201529 | 0.83 | IDH1 (0.57) | IDH1 | |
| SCHEMBL22201791 | 0.81 | IDH1 (0.49) | IDH1DNMT3AIDO1TDO2IDO2 | |
| SCHEMBL22201731 | 0.80 | IDH1 (0.57) | IDH1DNMT3A | |
| SCHEMBL19692697 | 0.80 | IDH1 (0.76) | IDH1 | |
| SCHEMBL19700699 | 0.78 | IDH1 (0.78) | 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 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 |