Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | WDR5 | P61964 | 3/20 | 0.42 |
| ▸ | LPL | P06858 | 6/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 6/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951984 | 0.95 | ESR1 (0.51) | ESR1CA1CA2THRATHRB | |
| SCHEMBL4814769 | 0.92 | ESR1 (0.42) | ESR1THRATHRBLPLLIPG | |
| SCHEMBL29957542 | 0.92 | ESR1 (0.42) | ESR1THRATHRBLPLLIPG | |
| SCHEMBL1155862 | 0.86 | CA1 (0.46) | ESR1CA1CA2LPLLIPG | |
| SCHEMBL15330986 | 0.85 | KDM4E (0.44) | ESR1 | |
| SCHEMBL29954924 | 0.84 | ESR1 (0.46) | ESR1CA2LPLLIPG | |
| SCHEMBL3659031 | 0.84 | ESR1 (0.46) | ESR1CA2LPLLIPG | |
| SCHEMBL2556271 | 0.84 | HTR1A (0.40) | ESR1LPLLIPG | |
| SCHEMBL2561666 | 0.83 | KDR (0.45) | CA1CA2 | |
| SCHEMBL257737 | 0.82 | ENPP2 (0.56) | CA1CA2THRATHRBLPL |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |