Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PEPD | P12955 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15212209 | 0.96 | CNR1 (0.43) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL15211535 | 0.92 | LTA4H (0.42) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL15211955 | 0.86 | ALDH1A1 (0.44) | CNR1CNR2KDM4EPOLBALDH1A1 | |
| SCHEMBL7587067 | 0.82 | GBA1 (0.42) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL30969014 | 0.82 | GBA1 (0.42) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL29264338 | 0.81 | LTA4H (0.43) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL29264336 | 0.81 | LTA4H (0.43) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL15211841 | 0.79 | MMP2 (0.45) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL29264319 | 0.78 | FKBP1A (0.42) | LTA4HCNR1CNR2CYP3A4KDM4E | |
| SCHEMBL7585001 | 0.78 | FKBP1A (0.42) | LTA4HCNR1CNR2CYP3A4KDM4E |
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-2817291-A1 | ANTIVIRAL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2014-12-31 | — | — | EP | disclosed |
| WO-2013124335-A1 | ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-08-29 | — | — | WO | disclosed |