Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | PER2 | O15055 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
| ▸ | PLK1 | P53350 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907954 | 0.91 | NR1H2 (0.36) | MAPK1NR1H2HDAC1HDAC8HDAC6 | |
| SCHEMBL3542987 | 0.87 | NOTUM (0.40) | MAPK1NR1H2NR1H3BRD4NOTUM | |
| SCHEMBL17907968 | 0.86 | HDAC1 (0.34) | MAPK1NR1H2HDAC1HDAC8HDAC6 | |
| SCHEMBL13279458 | 0.86 | CCR9 (0.34) | MAPK1NR1H2 | |
| SCHEMBL17907924 | 0.80 | NR1H2 (0.35) | MAPK1NR1H2 | |
| SCHEMBL17907949 | 0.79 | GABRA1 (0.35) | MAPK1 | |
| SCHEMBL17907981 | 0.78 | KDM4E (0.39) | NR1H2 | |
| SCHEMBL17907922 | 0.78 | KCNQ3 (0.38) | — | |
| SCHEMBL1770176 | 0.76 | KDM4E (0.34) | MAPK1 | |
| SCHEMBL21028079 | 0.67 | NR1H2 (0.37) | NR1H2NR1H3NOTUM |
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-2697223-B1 | 7-(HETEROARYL-AMINO)-6,7,8,9-TETRAHYDROPYRIDO[1,2-A]INDOL ACETIC ACID DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2016-07-13 | — | — | EP | disclosed |