Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16802013 | 0.89 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1KMT2AMEN1ATR | |
| SCHEMBL29950861 | 0.85 | HPGD (0.46) | KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL3178609 | 0.84 | CPT1A (0.44) | HSP90AA1HSP90AB1KMT2AMEN1ADORA3 | |
| SCHEMBL3178620 | 0.84 | CPT1A (0.44) | HSP90AA1HSP90AB1KMT2AMEN1ADORA3 | |
| SCHEMBL3787046 | 0.83 | KMT2A (0.54) | HSP90AA1HSP90AB1KMT2AMEN1ATR | |
| SCHEMBL29951652 | 0.83 | KCNQ4 (0.43) | ATRMAPT | |
| SCHEMBL29407156 | 0.83 | RAB9A (0.45) | ERN1SMN1; SMN2 | |
| SCHEMBL3158762 | 0.83 | MAPT (0.41) | HSP90AA1HSP90AB1KMT2AMEN1ATR | |
| SCHEMBL3158771 | 0.83 | MAPT (0.41) | HSP90AA1HSP90AB1KMT2AMEN1ATR | |
| SCHEMBL28738831 | 0.82 | PDK1 (0.56) | HSP90AA1HSP90AB1KMT2AMEN1PDK1 |
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 |