Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | BCL6 | P41182 | 3/20 | 0.40 |
| ▸ | BCOR | Q6W2J9 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | KLK7 | P49862 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4399623 | 0.84 | SMYD3 (0.47) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL1829208 | 0.76 | RXFP1 (0.50) | SMYD3MAPTKDM4EKMT2AGAA | |
| SCHEMBL12348283 | 0.76 | KIF11 (0.40) | MAPTKDM4EMEN1KMT2AGAA | |
| SCHEMBL1423203 | 0.73 | NOS1 (0.50) | SMYD3KDM4EMEN1KMT2ALMNA | |
| SCHEMBL1095502 | 0.73 | SIRT2 (0.69) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL4422966 | 0.72 | BCL6 (0.60) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL1119917 | 0.72 | MAPT (0.57) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL29511878 | 0.72 | BCL6 (0.60) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL28431190 | 0.72 | MAPT (0.49) | SMYD3MAPTKDM4EMEN1KMT2A | |
| SCHEMBL474689 | 0.71 | BCL6 (0.64) | MAPTKDM4EMEN1KMT2ALMNA |
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-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |