Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 5/20 | 0.49 |
| ▸ | FPR2 | P25090 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1735526 | 0.90 | SCN9A (0.49) | VCPFPR2SCN9AADORA3ADORA2B | |
| SCHEMBL1734296 | 0.87 | KDM4E (0.48) | VCPFPR2SCN9AADORA1ADORA2A | |
| SCHEMBL1734639 | 0.82 | VCP (0.70) | VCP | |
| SCHEMBL1734498 | 0.82 | VCP (0.47) | VCPFPR2SCN9AADORA1ADORA2A | |
| SCHEMBL1734123 | 0.79 | VCP (0.51) | VCPNPC1RAB9AADORA1ADORA2A | |
| SCHEMBL1733359 | 0.78 | ADORA1 (0.50) | VCPNPC1RAB9AADORA1ADORA2A | |
| SCHEMBL1735520 | 0.76 | KDM4E (0.56) | FPR2SCN9AADORA1ADORA2AADORA3 | |
| SCHEMBL1735530 | 0.76 | ADORA1 (0.46) | VCPADORA1ADORA2AADORA3ADORA2B | |
| SCHEMBL1734170 | 0.74 | VCP (0.51) | VCPNPC1RAB9AADORA1ADORA2A | |
| SCHEMBL1734512 | 0.73 | VCP (0.48) | VCPNPC1RAB9AADORA1ADORA2A |
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-1891018-B1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2011-11-16 | — | — | EP | claimed |
| WO-2011131686-A1 | A THERMALLY CONTROLLED ASSEMBLY | NAPATECH A/S (DK) | 2011-10-27 | — | — | WO | claimed |