Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 20/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 12/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 12/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 12/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 12/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 12/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 12/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 12/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.58 |
| ▸ | HDAC9 | Q9UKV0 | 12/20 | 0.58 |
| ▸ | HDAC5 | Q9UQL6 | 12/20 | 0.58 |
| ▸ | EGFR | P00533 | 5/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL29449678 | 1.00 | KDR (0.58) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449669 | 1.00 | KDR (0.58) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449666 | 0.91 | EGFR (0.59) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449690 | 0.91 | EGFR (0.59) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449687 | 0.91 | EGFR (0.59) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449655 | 0.89 | KDR (0.57) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449665 | 0.89 | KDR (0.57) | KDRHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL29449685 | 0.88 | KDR (0.57) | KDREGFR | |
| SCHEMBL29449686 | 0.88 | KDR (0.57) | KDREGFR | |
| SCHEMBL28691097 | 0.88 | KDR (0.57) | KDREGFR |
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-109942499-B | Quinazoline derivative and preparation method and application thereof | 湖南中医药大学 | 2022-03-22 | — | — | CN | disclosed |