Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CDC25B | P30305 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | CDC25A | P30304 | 1/20 | 0.40 |
| ▸ | CDC25C | P30307 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30887665 | 0.84 | ALDH1A1 (0.43) | CASP3KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL28680289 | 0.84 | ALDH1A1 (0.43) | CASP3KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL3265630 | 0.72 | MAPT (0.64) | CASP3KMT2AMEN1ALDH1A1CDC25B | |
| SCHEMBL27792820 | 0.72 | CASP3 (1.00) | CASP3ALOX15 | |
| SCHEMBL12202083 | 0.71 | CASP3 (0.45) | CASP3KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL8654624 | 0.70 | GAA (0.45) | KMT2AMEN1ALDH1A1KDM4EMAPT | |
| SCHEMBL9208732 | 0.69 | CASP3 (0.66) | CASP3ALDH1A1KDM4EMAPTCHRM2 | |
| SCHEMBL611001 | 0.68 | SCN9A (0.47) | ALDH1A1KDM4EMAPTPKMPOLB | |
| SCHEMBL29741442 | 0.68 | SCN9A (0.47) | ALDH1A1KDM4EMAPTPKMPOLB | |
| SCHEMBL29929651 | 0.68 | SCN9A (0.47) | ALDH1A1KDM4EMAPTPKMPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-113135924-B | Pyrimidine derivatives and their use in medicine | 广东东阳光药业股份有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-113135924-A | Pyrimidine derivatives and their use in medicine | 广东东阳光药业有限公司 | 2021-07-20 | — | — | CN | disclosed |