Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6531022 | 0.87 | DHODH (0.43) | CYP3A4CYP2C9GABRG2GABRB3GABRA3 | |
| SCHEMBL16703426 | 0.84 | GRM5 (0.40) | CYP3A4CYP2C9GABRG2GABRB3GABRA3 | |
| SCHEMBL10187777 | 0.68 | ALDH1A1 (0.40) | HDAC8TDP1KDM4E | |
| SCHEMBL30062391 | 0.67 | HDAC6 (0.54) | HDAC6HDAC8HDAC3HDAC4HDAC1 | |
| Dipyridyl SCHEMBL2792069 | 0.62 | KDM4E (0.74) | L3MBTL1TDP1ADORA3KDM4AKDM4B | |
| Dipyridyl SCHEMBL18601618 | 0.62 | KDM4E (0.74) | L3MBTL1TDP1ADORA3KDM4AKDM4B | |
| Dipyridyl SCHEMBL7773433 | 0.62 | KDM4E (0.74) | L3MBTL1TDP1ADORA3KDM4AKDM4B | |
| Dipyridyl SCHEMBL30976994 | 0.62 | KDM4E (0.74) | L3MBTL1TDP1ADORA3KDM4AKDM4B | |
| SCHEMBL5903774 | 0.61 | HDAC1 (1.00) | HDAC6HDAC8HDAC3HDAC4HDAC1 | |
| SCHEMBL13187688 | 0.60 | HDAC6 (0.53) | HDAC6HDAC8HDAC3HDAC4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2473501-A1 | COMPOUNDS AS TYROSINE KINASE MODULATORS | Allergan, Inc. (US) | 2012-07-11 | — | — | EP | disclosed |