Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10512168 | 0.82 | PTGS1 (0.37) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL11526451 | 0.81 | HDAC4 (0.46) | HDAC4HDAC7HDAC5CES2CES1 | |
| SCHEMBL2761650 | 0.81 | KMT2A (0.56) | KMT2AALDH1A1LMNA | |
| SCHEMBL28471244 | 0.78 | HDAC4 (0.53) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL30832115 | 0.76 | PTGS1 (0.60) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL15290689 | 0.76 | PTGS1 (0.60) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL15084962 | 0.75 | HDAC4 (0.50) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL29440604 | 0.75 | HDAC4 (0.50) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL75778 | 0.75 | HDAC4 (0.50) | HDAC4HDAC7HDAC5KDM4ECES2 | |
| SCHEMBL22807046 | 0.75 | HDAC4 (0.50) | HDAC4HDAC7HDAC5KDM4ECES2 |
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-104447347-A | Preparation method for sunitinibmalate intermediate | PARLING SHANGHAI PHARMATECH CO LTD | 2015-03-25 | — | — | CN | disclosed |