Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | RARG | P13631 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20425516 | 0.94 | SRD5A2 (0.47) | CYP2D6CYP2C9HIF1ACYP1A2SRD5A2 | |
| SCHEMBL3495875 | 0.92 | CYP2D6 (0.44) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL3304253 | 0.91 | CYP1A2 (0.57) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL9966556 | 0.90 | CYP2D6 (0.43) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL11168281 | 0.90 | KMT2A (0.50) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL28727642 | 0.89 | CYP1A2 (0.55) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL28727574 | 0.89 | CYP1A2 (0.55) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 | |
| SCHEMBL5317094 | 0.88 | MAPT (0.49) | MAPTALDH1A1 | |
| SCHEMBL30091181 | 0.85 | PTGS1 (0.50) | CYP2C9ESR1RARB | |
| SCHEMBL8984193 | 0.85 | CES2 (0.41) | CYP2D6CYP2C9HIF1ACYP1A2CYP2C19 |
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-114901653-A | Novel amide derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof | 株式会社LG化学 | 2022-08-12 | — | — | CN | disclosed |