Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28520992 | 0.96 | IDO1 (0.36) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28520988 | 0.96 | IDO1 (0.36) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28515391 | 0.96 | AAK1 (0.34) | AAK1LMNAATMSYKGAA | |
| SCHEMBL28515387 | 0.90 | IDO1 (0.35) | IDO1AAK1LMNAATMKLK5 | |
| SCHEMBL18428009 | 0.89 | IDO1 (0.38) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28521357 | 0.89 | IDO1 (0.38) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28527873 | 0.89 | IDO1 (0.35) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28529157 | 0.88 | IDO1 (0.36) | IDO1AAK1LMNAATMSMN1; SMN2 | |
| SCHEMBL28525900 | 0.88 | AAK1 (0.36) | AAK1LMNAATMSYKGAA | |
| SCHEMBL28514878 | 0.88 | IDO1 (0.36) | IDO1AAK1LMNAATMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108026026-B | Beta-substituted beta-amino acids and analogs as chemotherapeutic agents and uses thereof | 夸德里加生物科学公司 | 2021-02-09 | — | — | CN | disclosed |