Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.42 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 4/20 | 0.40 |
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | PLA2G6 | O60733 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.34 |
| ▸ | SLC13A3 | Q8WWT9 | 1/20 | 0.33 |
| ▸ | ACP1 | P24666 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4607191 | 0.81 | FABP4 (0.48) | CES1FABP4FAAHCES2PLA2G6 | |
| SCHEMBL4156245 | 0.79 | CES1 (0.44) | CES1HDAC1HDAC2MAPTMEN1 | |
| SCHEMBL4605614 | 0.69 | CES1 (0.45) | CES1FABP4HDAC1HDAC2MAPT | |
| SCHEMBL4168896 | 0.69 | CES1 (0.39) | CES1FABP4FAAHCES2PLA2G6 | |
| Trifluoroacetic Acid SCHEMBL4166937 | 0.69 | FABP4 (0.36) | CES1FABP4FAAHCES2PLA2G6 | |
| SCHEMBL4607673 | 0.68 | ALDH1A1 (0.50) | CES1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL26623605 | 0.65 | L3MBTL1 (0.49) | HDAC1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL11613307 | 0.64 | FABP4 (0.60) | FABP4MAPTMEN1KMT2ARAB9A | |
| SCHEMBL15708595 | 0.64 | EGFR (0.66) | FABP4EGFRMAPTMEN1KMT2A | |
| SCHEMBL15708598 | 0.64 | EGFR (0.66) | FABP4EGFRMAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945609-A2 | AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007029036-A2 | AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-03-15 | — | — | WO | disclosed |