Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 3/20 | 0.51 |
| ▸ | SIRT7 | Q9NRC8 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 2/20 | 0.40 |
| ▸ | FLT4 | P35916 | 2/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22925752 | 0.81 | VCP (0.63) | VCPSIRT7KDRDGAT1HDAC1 | |
| SCHEMBL5319683 | 0.75 | KDR (0.78) | VCPSIRT7KDRTRPV1FLT1 | |
| SCHEMBL28733818 | 0.73 | VCP (0.52) | VCPSIRT7KDRDGAT1TRPV1 | |
| SCHEMBL29624679 | 0.71 | HDAC6 (0.65) | HDAC1HDAC6HDAC8HDAC3HDAC7 | |
| SCHEMBL20096600 | 0.71 | HDAC6 (0.65) | HDAC1HDAC6HDAC8HDAC3HDAC7 | |
| SCHEMBL28733778 | 0.70 | VCP (0.64) | VCPSIRT7KDRDGAT1FLT1 | |
| SCHEMBL29696299 | 0.70 | TRPV1 (0.45) | KDRDGAT1TRPV1HDAC1HDAC6 | |
| SCHEMBL22925659 | 0.70 | TRPV1 (0.45) | KDRDGAT1TRPV1HDAC1HDAC6 | |
| SCHEMBL31013371 | 0.68 | VCP (0.46) | VCPKDRDGAT1TRPV1HDAC1 | |
| SCHEMBL22925735 | 0.68 | VCP (0.46) | VCPKDRDGAT1TRPV1HDAC1 |
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-114450281-A | Inhibitor compounds | 辛塞拉治疗私人有限公司 | 2022-05-06 | — | — | CN | disclosed |