Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20202915 | 0.97 | CYP2C9 (0.36) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL20202913 | 0.92 | CYP2C9 (0.41) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL16258074 | 0.92 | CYP2C9 (0.35) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL19722077 | 0.89 | DRD2 (0.40) | CYP2C9CYP3A4APPCYP2D6CYP2C19 | |
| SCHEMBL18472153 | 0.89 | CYP2C9 (0.38) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL16117391 | 0.89 | CYP2C9 (0.40) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL16258087 | 0.88 | CYP2C9 (0.35) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL18472181 | 0.88 | CYP2C9 (0.38) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL1815168 | 0.88 | CYP2C9 (0.38) | CYP2C9CYP3A4APPMAPTALDH1A1 | |
| SCHEMBL20202912 | 0.88 | CYP3A4 (0.37) | CYP2C9CYP3A4APPMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20180148647-A1 | COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAME | DIC CORPORATION (JP) | 2018-05-31 | — | — | US | disclosed |