Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12705102 | 0.92 | ALDH1A1 (0.51) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL18545056 | 0.87 | ALDH1A1 (0.48) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL20610685 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL11952855 | 0.84 | SIGMAR1 (0.54) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL12942964 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL12906773 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL12906765 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL12906769 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL12906774 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E | |
| SCHEMBL21440842 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TDP1SIGMAR1SMN1; SMN2KDM4E |
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-113195498-A | Novel imidazopyrazine derivatives | 豪夫迈·罗氏有限公司 | 2021-07-30 | — | — | CN | disclosed |