Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3756783 | 0.87 | NOTUM (0.44) | ALDH1A1GAAPKMSMN1; SMN2L3MBTL1 | |
| SCHEMBL1880517 | 0.80 | MAPT (0.47) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL3759645 | 0.79 | MAPT (0.55) | MAPTTHRBARALDH1A1GAA | |
| SCHEMBL1877442 | 0.76 | MAPT (0.49) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL1875614 | 0.76 | GAA (0.60) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL1890367 | 0.74 | GAA (0.48) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL1884213 | 0.73 | MAPT (0.46) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL182807 | 0.73 | MAPK8 (0.57) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL1887533 | 0.71 | MAPK8 (0.50) | MAPK8MAPTTHRBARALDH1A1 | |
| SCHEMBL1884680 | 0.70 | NOTUM (0.51) | ALDH1A1GAAKDM4EKMT2ASMN1; SMN2 |
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-2185506-A1 | PYRROLE COMPOUNDS HAVING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST OR ANTAGONIST BIOLOGICAL ACTIVITY | Allergan, Inc. (US) | 2010-05-19 | — | — | EP | disclosed |
| WO-2009026407-A1 | PYRROLE COMPOUNDS HAVING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST OR ANTAGONIST BIOLOGICAL ACTIVITY | ALLERGAN, INC. (US) | 2009-02-26 | — | — | WO | disclosed |