Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 7/20 | 0.56 |
| ▸ | TBK1 | Q9UHD2 | 10/20 | 0.46 |
| ▸ | VEGFA | P15692 | 1/20 | 0.46 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28659928 | 0.85 | IDH1 (0.51) | — | |
| SCHEMBL19701241 | 0.85 | IDH1 (0.51) | — | |
| SCHEMBL19700736 | 0.82 | ACHE (0.47) | ACHETBK1VEGFAEGLN1 | |
| SCHEMBL19700697 | 0.81 | DNMT3A (0.54) | ACHETBK1VEGFAEGLN1HTT | |
| SCHEMBL1825509 | 0.79 | TBK1 (0.53) | TBK1VEGFAEGLN1POLB | |
| SCHEMBL19700739 | 0.79 | IDH1 (0.60) | — | |
| SCHEMBL12557699 | 0.78 | KMT2A (0.69) | VEGFAEGLN1POLB | |
| SCHEMBL22201790 | 0.77 | IDH1 (0.63) | — | |
| SCHEMBL5536182 | 0.77 | VEGFA (0.68) | VEGFAEGLN1HTTSMN1; SMN2NPSR1 | |
| SCHEMBL2396520 | 0.77 | VEGFA (0.50) | TBK1VEGFAEGLN1POLB |
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 |