Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2597079 | 0.77 | ATM (0.41) | LMNAKMT2AMAPTESPL1ATM | |
| SCHEMBL30675699 | 0.76 | HDAC1 (0.46) | HDAC1HDAC8HDAC6TP53LMNA | |
| SCHEMBL30675667 | 0.76 | HDAC1 (0.49) | HDAC1HDAC8HDAC6TP53LMNA | |
| SCHEMBL30806271 | 0.75 | KIF11 (0.44) | LMNAKMT2AESPL1ATMTDP1 | |
| SCHEMBL21646065 | 0.75 | KIF11 (0.44) | LMNAKMT2AESPL1ATMTDP1 | |
| SCHEMBL10353386 | 0.74 | SNCA (0.52) | HDAC1HDAC8HDAC6LMNAKMT2A | |
| SCHEMBL9835657 | 0.73 | PGR (0.46) | ESPL1ATMTDP1ALDH1A1PGR | |
| SCHEMBL31374883 | 0.72 | HDAC1 (0.43) | HDAC1HDAC8HDAC6TP53LMNA | |
| SCHEMBL19030880 | 0.71 | PGR (0.43) | TP53LMNAKMT2AMAPTESPL1 | |
| SCHEMBL5507140 | 0.71 | HDAC1 (0.57) | HDAC1HDAC8HDAC6TP53LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-116964048-A | Bicyclic tetrahydroazepine derivatives for the treatment of cancer | 豪夫迈·罗氏有限公司 | 2023-10-27 | — | — | CN | disclosed |