Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 6/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | ALDH3A1 | P30838 | 3/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | PSIP1 | O75475 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10634307 | 0.85 | LMNA (0.40) | CYP2C9CYP2C19CYP1A2LMNAPNMT | |
| SCHEMBL2054720 | 0.80 | ALDH1A1 (0.44) | CYP2C9CYP2C19CYP3A4ALDH1A1ALDH3A1 | |
| SCHEMBL22404411 | 0.72 | GAA (0.42) | CYP2C9CYP2C19CYP1A2LMNAPNMT | |
| SCHEMBL10631511 | 0.72 | ALDH1A1 (0.46) | CYP2C9CYP2C19LMNAPNMTCYP3A4 | |
| SCHEMBL10637840 | 0.71 | KDM4E (0.44) | CYP2C9CYP2C19CYP1A2LMNAPNMT | |
| SCHEMBL3510826 | 0.71 | SOD1 (0.44) | CYP2C9CYP2C19CYP1A2LMNAPNMT | |
| SCHEMBL10634274 | 0.70 | THRB (0.50) | CYP2C9CYP2C19CYP3A4ALDH1A1THRB | |
| SCHEMBL3583336 | 0.69 | CA12 (0.39) | LMNAALDH1A1PSIP1 | |
| SCHEMBL20488818 | 0.68 | ALDH1A3 (0.49) | CYP1A2ALDH1A1ALDH3A1ALDH1A3THRB | |
| SCHEMBL10637864 | 0.68 | THRB (0.53) | CYP2C9CYP2C19CYP3A4ALDH1A1THRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021220011-A1 | ANTI-INFECTIVE BICYCLIC PEPTIDE CONJUGATES | BICYCLETX LIMITED (GB) | 2021-11-04 | — | — | WO | disclosed |