Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 6/20 | 0.56 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.53 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL5090111 | 0.84 | PFKFB3 (0.65) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL5090108 | 0.84 | PFKFB3 (0.65) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL5507715 | 0.81 | PFKFB3 (0.74) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL10275157 | 0.81 | PFKFB3 (0.74) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL5096130 | 0.80 | PFKFB3 (0.52) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL5096126 | 0.80 | PFKFB3 (0.52) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL28289894 | 0.80 | ALOX5 (0.61) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL27684619 | 0.79 | PFKFB3 (0.51) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL28288480 | 0.77 | ALOX5 (0.58) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 | |
| SCHEMBL27985742 | 0.77 | CCR1 (0.41) | PFKFB3CYSLTR2CYSLTR1HDAC6ALOX5 |
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-1964946-A | 2-propen-1-ones as HSP 70 inducers | TORRENT PHARMACEUTICALS LTD (IN) | 2007-05-16 | — | — | CN | disclosed |