Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 3/20 | 0.55 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.55 |
| ▸ | CTSK | P43235 | 2/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | CTSS | P25774 | 1/20 | 0.55 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.52 |
| ▸ | GLS | O94925 | 3/20 | 0.52 |
| ▸ | KDM4A | O75164 | 1/20 | 0.49 |
| ▸ | PADI3 | Q9ULW8 | 1/20 | 0.48 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 2/20 | 0.46 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.46 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.46 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18664426 | 0.97 | HDAC1 (0.60) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL2568359 | 0.93 | HDAC1 (0.56) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL16410240 | 0.93 | BRD4 (0.53) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL6242494 | 0.92 | HDAC1 (0.55) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL18664572 | 0.92 | GRM2 (0.54) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL301717 | 0.92 | PRMT6 (0.56) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL2572109 | 0.92 | HDAC1 (0.52) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL5549803 | 0.91 | HDAC1 (0.60) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL16410438 | 0.90 | BRD4 (0.51) | HDAC1BRD4CREBBPCTSKCTSB | |
| SCHEMBL6243284 | 0.90 | HDAC1 (0.51) | HDAC1BRD4CREBBPCTSKCTSB |
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-116490507-A | Heterocyclic condensation CDC7 kinase inhibitors for the treatment of cancer | 薛定谔公司 | 2023-07-25 | — | — | CN | disclosed |