Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 6/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.47 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PDE5A | O76074 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1958693 | 0.91 | ADORA3 (0.42) | ADORA1ADORA3ADORA2AHPGDSLTA4H | |
| SCHEMBL1959384 | 0.90 | ADORA3 (0.41) | ADORA1ADORA3ADORA2AHPGDSLTA4H | |
| SCHEMBL1411948 | 0.84 | HPGDS (0.54) | ADORA1ADORA3ADORA2AHPGDSRAB9A | |
| SCHEMBL1959601 | 0.83 | LTA4H (0.45) | ADORA1ADORA3ADORA2ALTA4HCYP1A2 | |
| SCHEMBL1961659 | 0.81 | LTA4H (0.36) | LTA4HKMT2ACASRLMNAPOLB | |
| SCHEMBL1958224 | 0.79 | MAPT (0.39) | HPGDSNPC1RAB9AKMT2AMAPT | |
| SCHEMBL1961157 | 0.79 | NPC1 (0.38) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL1960975 | 0.79 | L3MBTL1 (0.41) | ADORA1ADORA3ADORA2AHPGDSNPC1 | |
| SCHEMBL1961068 | 0.78 | CYP11B1 (0.50) | ADORA1ADORA3ADORA2AHPGDSNPC1 | |
| SCHEMBL1959738 | 0.78 | LTA4H (0.55) | LTA4HNPC1RAB9AL3MBTL1KMT2A |
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-1521754-A2 | VIRAL INHIBITORS | K.U.Leuven Research & Development (BE) | 2005-04-13 | — | — | EP | disclosed |
| WO-2004005286-A2 | VIRAL INHIBITORS | K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) | 2004-01-15 | — | — | WO | disclosed |