Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | LIG1 | P18858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL10938257 | 0.79 | CYP19A1 (0.40) | ALDH1A1ALOX12MAP1LC3BKMT2AMAPT | |
| SCHEMBL10938628 | 0.78 | MAPT (0.43) | KMT2ACYP1A2CYP3A4MAPTMAPK1 | |
| SCHEMBL24516489 | 0.75 | DDB1 (0.49) | ALDH1A1SMN1; SMN2ALOX12RAB9AKMT2A | |
| SCHEMBL28640519 | 0.72 | POLB (0.54) | SLC6A2SLC6A3ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL24516525 | 0.71 | SLC6A4 (0.46) | SLC6A2SLC6A3KDM4ESLC6A4CYP2D6 | |
| SCHEMBL15282087 | 0.68 | SRD5A1 (0.43) | SLC6A2SLC6A3ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL24516524 | 0.68 | TP53 (0.50) | SLC6A3ALDH1A1SMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL900117 | 0.67 | HTR3A (0.50) | SLC6A2SLC6A3ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL425308 | 0.67 | POLB (0.58) | SLC6A2SLC6A3ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL11309960 | 0.67 | SRD5A1 (0.39) | SLC6A2SLC6A3ALDH1A1SMN1; SMN2POLB |
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-2022122975-A1 | CYCLOPENTENONES DERIVATIVES AND THEIR USE AS ANTIBIOTICS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2022-06-16 | — | — | WO | disclosed |