Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16398534 | 0.80 | NUDT1 (0.42) | ALDH1A1PIK3CA | |
| SCHEMBL24982859 | 0.77 | P2RX7 (0.40) | GABRA1GABRG2GABRB3SMN1; SMN2 | |
| SCHEMBL16115628 | 0.77 | GABRA1 (0.34) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL28159341 | 0.76 | AAK1 (0.36) | ALDH1A1HDAC1HDAC6PIK3CA | |
| SCHEMBL3966140 | 0.75 | NUDT1 (0.43) | ALDH1A1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL16397831 | 0.75 | TACR1 (0.36) | ALDH1A1 | |
| SCHEMBL28159759 | 0.73 | RXRA (0.34) | ALDH1A1PIK3CA | |
| SCHEMBL24982790 | 0.73 | S1PR4 (0.43) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL28159338 | 0.73 | ALDH1A1 (0.31) | ALDH1A1PIK3CA | |
| SCHEMBL28159337 | 0.72 | ALDH1A1 (0.37) | ALDH1A1GABRA1GABRG2GABRB3GABRA3 |
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-105263923-B | Pyrimidine compounds and their use as gamma secretase modulators | 阿克图拉姆生命科学股份公司 | 2017-06-23 | — | — | CN | disclosed |