Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29956454 | 0.88 | CYP3A4 (0.47) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL4037887 | 0.88 | CYP3A4 (0.47) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL29951692 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MAPTHPGDLMNATP53 | |
| SCHEMBL14875768 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MAPTHPGDLMNATP53 | |
| SCHEMBL29951882 | 0.81 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL8574746 | 0.80 | ALDH1A1 (0.53) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL4472813 | 0.79 | HPGD (0.51) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL29957503 | 0.78 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1TSHRALDH1A1HPGD | |
| SCHEMBL16942492 | 0.78 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT | |
| SCHEMBL4474687 | 0.78 | CYP4F2 (0.48) | HSP90AA1HSP90AB1TSHRALDH1A1MAPT |
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 |