Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.51 |
| ▸ | RXRB | P28702 | 1/20 | 0.51 |
| ▸ | RXRG | P48443 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 4/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 7/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20439390 | 0.95 | RXRA (0.51) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL21797086 | 0.85 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL20437662 | 0.85 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL22655786 | 0.85 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL20437973 | 0.85 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL30380061 | 0.85 | RXRA (0.51) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL29000796 | 0.85 | RXRA (0.51) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL21856863 | 0.82 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL20437571 | 0.82 | RXRA (0.51) | RXRARXRBRXRGALDH1A1POLB | |
| SCHEMBL29535892 | 0.82 | RXRA (0.48) | RXRARXRBRXRGALDH1A1POLB |
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-113831326-A | Condensed heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2021-12-24 | — | — | CN | disclosed |