Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOX | P28300 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | RXRA | P19793 | 5/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.36 |
| ▸ | MGMT | P16455 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28619751 | 0.87 | ALDH1A1 (0.50) | RXRAGRIN1GRIN2BALDH1A1 | |
| SCHEMBL12015 | 0.76 | CCR1 (0.41) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL29520064 | 0.76 | CCR1 (0.41) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL27990718 | 0.74 | CCR1 (0.40) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL4271456 | 0.74 | ALKBH1 (0.47) | ALDH1A1 | |
| SCHEMBL28020288 | 0.74 | MAPK8 (0.42) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL28020330 | 0.74 | TSHR (0.38) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL16815519 | 0.73 | RXRA (0.43) | ABCB1RXRAGRIN1GRIN2BPIK3CA | |
| SCHEMBL30721403 | 0.72 | LOX (0.40) | LOXLOXL2RXRAGRIN1GRIN2B | |
| SCHEMBL8670180 | 0.72 | AOC3 (0.41) | PIK3CAALDH1A1 |
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-104725397-A | Thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them | SERVIER LAB | 2015-06-24 | — | — | CN | disclosed |