Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | METAP2 | P50579 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13150839 | 0.80 | TP53 (0.43) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL13150879 | 0.80 | TP53 (0.43) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL27818841 | 0.79 | TP53 (0.44) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL27797952 | 0.77 | THRB (0.42) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL3996792 | 0.76 | TP53 (0.47) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL6592409 | 0.76 | TP53 (0.47) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL5686769 | 0.76 | EPHX1 (0.46) | TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL503695 | 0.76 | EPHX1 (0.46) | TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL67018 | 0.76 | EPHX1 (0.46) | TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL360610 | 0.76 | EPHX1 (0.46) | TP53ALDH1A1SMN1; SMN2 |
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-2023214426-A1 | PROCESS FOR THE PREPARATION OF R-OXYBUTYNIN HYDROCHLORIDE | HARMAN FINOCHEM LIMITED (IN) | 2023-11-09 | — | — | WO | disclosed |