Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19881211 | 0.85 | HDAC4 (0.47) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL27427626 | 0.85 | HDAC4 (0.47) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL27795851 | 0.83 | HDAC4 (0.46) | HDAC4HDAC7HDAC5CES2CES1 | |
| Hydrochloric Acid SCHEMBL27533449 | 0.80 | HDAC4 (0.43) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL28165650 | 0.78 | AOC3 (0.43) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL8823897 | 0.78 | HCAR2 (0.58) | KMT2ALMNAOPRM1 | |
| SCHEMBL5692198 | 0.78 | HCAR2 (0.58) | KMT2ALMNAOPRM1 | |
| SCHEMBL8823875 | 0.78 | HCAR2 (0.58) | KMT2ALMNAOPRM1 | |
| SCHEMBL8498061 | 0.77 | HDAC4 (0.50) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL3883489 | 0.77 | HDAC4 (0.42) | HDAC4HDAC7HDAC5CES2CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105142640-B | Tyrosine protein kinase inhibitor | 豪夫迈·罗氏有限公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-105142640-A | Inhibitors of bruton's tyrosine kinase | HOFFMANN LA ROCHE | 2015-12-09 | — | — | CN | disclosed |