Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PABPC1 | P11940 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSPO | P30536 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12294859 | 0.88 | ALDH1A1 (0.42) | PABPC1ALDH1A1POLBGAATSPO | |
| SCHEMBL15266482 | 0.77 | ALDH1A1 (0.51) | ALDH1A1POLBGAACYP1A2CYP2C9 | |
| SCHEMBL7913154 | 0.77 | PARP1 (0.42) | ALDH1A1POLBGAACYP1A2CYP2C9 | |
| SCHEMBL6101878 | 0.74 | PABPC1 (0.56) | PABPC1ALDH1A1POLBGAATSPO | |
| SCHEMBL7655591 | 0.72 | ALDH1A1 (0.52) | ALDH1A1GAATSPONR1I2ABCB11 | |
| SCHEMBL19116278 | 0.71 | NPC1 (0.55) | PABPC1ALDH1A1POLBGAAPKM | |
| SCHEMBL12844547 | 0.70 | PABPC1 (0.52) | PABPC1ALDH1A1POLBGAATSPO | |
| SCHEMBL9203119 | 0.70 | PABPC1 (0.43) | PABPC1ALDH1A1POLBGAATSPO | |
| SCHEMBL1430433 | 0.70 | CYP1A2 (0.52) | ALDH1A1GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23655363 | 0.69 | ALDH1A1 (0.46) | PABPC1ALDH1A1POLBGAATSPO |
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 |
|---|---|---|---|---|---|---|---|
| EP-3027615-B1 | ANTI-INFECTIVE COMPOUNDS | PASTEUR INSTITUT KOREA (KR) | 2021-07-21 | — | — | EP | disclosed |