Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4128726 | 0.81 | KDM4E (0.48) | MAPK1GAA | |
| SCHEMBL4129005 | 0.76 | HCAR3 (0.58) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL4129011 | 0.76 | HCAR3 (0.58) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL4129007 | 0.76 | HCAR3 (0.58) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL718625 | 0.75 | MAPK1 (0.65) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL28497372 | 0.74 | MAPT (0.62) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL28497373 | 0.74 | MAPT (0.62) | MAPK1HCAR3ALDH1A1GAAKMT2A | |
| SCHEMBL16989741 | 0.74 | MAPK1 (0.49) | MAPK1HCAR3ALDH1A1GAAPDK1 | |
| SCHEMBL16989740 | 0.74 | MAPK1 (0.49) | MAPK1HCAR3ALDH1A1GAAPDK1 | |
| SCHEMBL16989738 | 0.74 | MAPK1 (0.49) | MAPK1HCAR3ALDH1A1GAAPDK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1778231-A4 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2009-06-03 | — | — | EP | disclosed |
| EP-1778231-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006020415-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-02-23 | — | — | WO | disclosed |