Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30392400 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4EPHX1NR1H2ELANE | |
| SCHEMBL30571945 | 1.00 | ALDH1A1 (0.44) | ALDH1A1CYP3A4EPHX1NR1H2ELANE | |
| SCHEMBL29523552 | 0.99 | ALDH1A1 (0.42) | ALDH1A1CYP3A4EPHX1NR1H2ELANE | |
| SCHEMBL30181036 | 0.96 | NR1H2 (0.40) | ALDH1A1CYP3A4EPHX1NR1H2MMP2 | |
| SCHEMBL7629700 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CYP3A4EPHX1NR1H2MMP2 | |
| SCHEMBL6184237 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CYP3A4EPHX1NR1H2MMP2 | |
| SCHEMBL30396157 | 0.93 | CYP3A4 (0.43) | ALDH1A1CYP3A4NR1H2MMP2ANPEP | |
| SCHEMBL18084464 | 0.89 | NR1H2 (0.43) | ALDH1A1CYP3A4NR1H2MMP2ANPEP | |
| SCHEMBL15013224 | 0.88 | NPC1 (0.42) | ALDH1A1CYP3A4EPHX1NR1H2NR1H3 | |
| SCHEMBL1782216 | 0.86 | HSD17B10 (0.44) | EPHX1NR1H2ELANENR1H3HSD17B10 |
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-2023183405-A2 | PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS | ALEXION PHARMACEUTICALS, INC. (US) | 2023-09-28 | — | — | WO | disclosed |