Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | MDM2 | Q00987 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | APAF1 | O14727 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.48 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.46 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2027394 | 0.85 | ALDH1A1 (0.72) | ALDH1A1MDM2TP53 | |
| SCHEMBL14991625 | 0.83 | MDM2 (0.47) | CASP3MDM2TP53CMA1TDP1 | |
| SCHEMBL30930026 | 0.82 | RPS6KA2 (0.44) | ALDH1A1CASP3MDM2KDM4ECMA1 | |
| SCHEMBL18863310 | 0.82 | MDM2 (0.46) | ALDH1A1CASP3MDM2CMA1TDP1 | |
| SCHEMBL29217149 | 0.82 | RPS6KA2 (0.44) | ALDH1A1CASP3MDM2KDM4ECMA1 | |
| SCHEMBL1476736 | 0.82 | PARK7 (0.46) | CASP3MDM2TP53CMA1TDP1 | |
| SCHEMBL14991574 | 0.82 | MDM2 (0.46) | ALDH1A1CASP3MDM2CMA1TDP1 | |
| SCHEMBL21325286 | 0.81 | MDM2 (0.51) | ALDH1A1CASP3MDM2TP53MEN1 | |
| SCHEMBL20100132 | 0.81 | MDM2 (0.61) | MDM2TP53SCN9A | |
| SCHEMBL21496819 | 0.79 | KDM4E (0.42) | ALDH1A1CASP3TP53KDM4ECMA1 |
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-108602814-A | Pyrrolo-, pyrazolo-, imidazo-pyrimidine and pyridine compounds inhibiting MNK1 and MNK2 | 效应治疗股份有限公司 | 2018-09-28 | — | — | CN | disclosed |