Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 3/20 | 0.30 |
| ▸ | NOS1 | P29475 | 3/20 | 0.30 |
| ▸ | NOS2 | P35228 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16623071 | 0.74 | CA1 (0.64) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL18010900 | 0.74 | CA1 (0.64) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL15624126 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL20590515 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL11137251 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL7948590 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL3818356 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL14232322 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL7459795 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 | |
| SCHEMBL14125364 | 0.74 | CA1 (0.56) | CA1CA9ALDH1A1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4006130-A1 | ISOMER MIXTURES OF UNSATURATED MACROCYCLIC MUSK COMPOUNDS | Symrise AG (DE) | 2022-06-01 | — | — | EP | disclosed |