Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | LSS | P48449 | 2/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA3 | P07451 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6961851 | 0.98 | CHRM2 (0.48) | CHRM2LSSDNM1CA12CA1 | |
| SCHEMBL6967400 | 0.91 | — | — | |
| SCHEMBL26969191 | 0.87 | CHRM2 (0.43) | CHRM2LMNASIGMAR1ALDH1A1ADH1C | |
| SCHEMBL6050562 | 0.86 | CHRM2 (0.43) | CHRM2LSSSIGMAR1 | |
| SCHEMBL24654499 | 0.84 | CHRM2 (0.37) | CHRM2LMNASIGMAR1 | |
| SCHEMBL13744684 | 0.83 | CHRM2 (0.33) | CHRM2LSSMEN1KMT2A | |
| SCHEMBL3429977 | 0.80 | — | — | |
| SCHEMBL3323907 | 0.80 | HRH4 (0.40) | CHRM2LMNASIGMAR1ALDH1A1ADH1C | |
| SCHEMBL11569526 | 0.79 | ADH1C (0.53) | LSSDNM1CA12CA1CA2 | |
| SCHEMBL11570725 | 0.79 | ADH1C (0.53) | LSSDNM1CA12CA1CA2 |
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-2023086432-A1 | PRODRUGS OF NEUROSTEROID ANALOGS AND USES THEREOF | EMORY UNIVERSITY (US) | 2023-05-19 | — | — | WO | disclosed |