Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9698627 | 0.83 | HDAC1 (0.55) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL11133561 | 0.81 | ALOX5 (0.53) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL114130 | 0.80 | HDAC1 (0.64) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL4666437 | 0.80 | HDAC1 (0.64) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL19656183 | 0.80 | HDAC1 (0.50) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL6705875 | 0.80 | HDAC1 (0.50) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| Hydrochloric Acid SCHEMBL11273048 | 0.79 | HDAC1 (0.62) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL27918597 | 0.79 | CES1 (0.48) | HDAC8HDAC6MAPK1SMN1; SMN2MAPT | |
| SCHEMBL28770542 | 0.79 | HDAC1 (0.62) | HDAC1HDAC3HDAC2HDAC8HDAC6 | |
| SCHEMBL28765013 | 0.79 | MAPT (0.54) | HDAC1HDAC3HDAC2HDAC8HDAC6 |
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-109803968-A | Pyridopyrimidinone CDK2/4/6 inhibitor | 辉瑞公司 | 2019-05-24 | — | — | CN | disclosed |