Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PER2 | O15055 | 3/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907950 | 0.91 | MAPK1 (0.33) | NR1H2MAPK1PER2HDAC1HDAC8 | |
| SCHEMBL17907924 | 0.87 | NR1H2 (0.35) | NR1H2KDM4EALDH1A1SIGMAR1MAPK1 | |
| SCHEMBL17907949 | 0.86 | GABRA1 (0.35) | ALDH1A1MAPK1 | |
| SCHEMBL17907981 | 0.85 | KDM4E (0.39) | NR1H2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL17907922 | 0.84 | KCNQ3 (0.38) | — | |
| SCHEMBL3542987 | 0.84 | NOTUM (0.40) | NR1H2SIGMAR1MAPK1 | |
| SCHEMBL17907968 | 0.80 | HDAC1 (0.34) | NR1H2MAPK1HDAC1HDAC8HDAC6 | |
| SCHEMBL13279458 | 0.79 | CCR9 (0.34) | NR1H2ALDH1A1MAPK1 | |
| SCHEMBL1770176 | 0.74 | KDM4E (0.34) | KDM4EALDH1A1MAPK1 | |
| SCHEMBL21525111 | 0.67 | NR1H2 (0.42) | NR1H2HDAC1PLK1 |
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 |