Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | PDE9A | O76083 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.35 |
| ▸ | PPARD | Q03181 | 6/20 | 0.35 |
| ▸ | PPARA | Q07869 | 5/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907946 | 1.00 | PDE5A (0.40) | PDE5APDE9ACCR2CACNA1BKDM4E | |
| SCHEMBL17907944 | 0.87 | ALDH1A1 (0.37) | CCR2CACNA1BKDM4EALDH1A1LMNA | |
| SCHEMBL17907945 | 0.87 | ALDH1A1 (0.37) | CCR2CACNA1BKDM4EALDH1A1LMNA | |
| SCHEMBL17907937 | 0.86 | CCR9 (0.42) | CCR2CACNA1BKDM4EALDH1A1KMO | |
| SCHEMBL17907939 | 0.86 | CCR9 (0.42) | CCR2CACNA1BKDM4EALDH1A1KMO | |
| SCHEMBL3553083 | 0.84 | KDM4E (0.46) | CCR2CACNA1BKDM4EALDH1A1MEN1 | |
| SCHEMBL3553079 | 0.84 | KDM4E (0.46) | CCR2CACNA1BKDM4EALDH1A1MEN1 | |
| SCHEMBL17907996 | 0.80 | CACNA1B (0.40) | CCR2CACNA1BKDM4EALDH1A1LMNA | |
| SCHEMBL17907997 | 0.80 | CACNA1B (0.40) | CCR2CACNA1BKDM4EALDH1A1LMNA | |
| SCHEMBL17907927 | 0.80 | CACNA1B (0.44) | CACNA1BKDM4EALDH1A1MAPTMEN1 |
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 |