Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 9/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.42 |
| ▸ | BCHE | P06276 | 4/20 | 0.42 |
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL26086346 | 1.00 | CYP1A2 (0.47) | CYP1A2HIF1ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL26087454 | 0.88 | SMPD1 (0.52) | CYP3A4CYP2D6KMT2AMEN1POLB | |
| SCHEMBL8608079 | 0.80 | GAA (0.47) | CYP3A4CYP2D6ALDH1A1KMT2AMEN1 | |
| SCHEMBL30380374 | 0.79 | KCNT1 (0.59) | CYP1A2HIF1ACYP2C9CYP2C19KCNT1 | |
| SCHEMBL26086370 | 0.77 | CHRM2 (0.50) | CYP3A4CYP2D6ALDH1A1KMT2AMEN1 | |
| SCHEMBL26086379 | 0.77 | CA12 (0.62) | CYP1A2HIF1ACYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11593078 | 0.75 | KCNT1 (0.60) | CYP1A2HIF1ACYP2C9CYP2C19KCNT1 | |
| SCHEMBL12530633 | 0.71 | KCNT1 (0.56) | CYP1A2HIF1ACYP2C9CYP2C19KCNT1 | |
| SCHEMBL26086339 | 0.71 | KCNT1 (0.51) | CYP1A2CYP2D6CYP2C9CYP2C19KCNT1 | |
| SCHEMBL26411467 | 0.70 | HTR2A (0.41) | CYP3A4CYP2D6KMT2AMEN1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4423055-A1 | SPERMINE DERIVATIVES AS HEPARIN ANTIDOTES | Consejo Superior de Investigaciones Cientificas (ES) | 2024-09-04 | — | — | EP | disclosed |
| WO-2023072434-A1 | SPERMINE DERIVATIVES AS HEPARIN ANTIDOTES | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (ES) | 2023-05-04 | — | — | WO | disclosed |