Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28685922 | 0.90 | SMN1; SMN2 (0.40) | NR3C2KDM1AMAOAGAASMN1; SMN2 | |
| SCHEMBL14270218 | 0.84 | SMN1; SMN2 (0.52) | NR3C2KDM1AMAOAGAASMN1; SMN2 | |
| SCHEMBL28703351 | 0.83 | CA12 (0.49) | SMN1; SMN2CA12CA9L3MBTL1CYP1A2 | |
| SCHEMBL19553599 | 0.76 | CA12 (0.61) | GAASMN1; SMN2CA12CA9L3MBTL1 | |
| SCHEMBL506160 | 0.76 | SMN1; SMN2 (0.57) | NR3C2KDM1AMAOAGAASMN1; SMN2 | |
| SCHEMBL17982515 | 0.72 | HDAC3 (0.40) | ALDH1A1 | |
| SCHEMBL28686065 | 0.71 | TAAR1 (0.50) | SMN1; SMN2L3MBTL1CYP1A2ALDH1A1 | |
| SCHEMBL27420174 | 0.69 | CA1 (0.59) | NR3C2GAASMN1; SMN2CA12CA9 | |
| SCHEMBL13437571 | 0.69 | TRPA1 (0.43) | GAACYP3A4ALDH1A1 | |
| SCHEMBL22504876 | 0.69 | TRPA1 (0.43) | GAACYP3A4ALDH1A1 |
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-109311882-A | adenine derivatives as protein kinase inhibitors | BCI制药公司 | 2019-02-05 | — | — | CN | disclosed |