Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.45 |
| ▸ | KIT | P10721 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 3/20 | 0.42 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.41 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3339979 | 0.94 | KIT (0.48) | MAP3K11KITNPC1CFTRPIK3CA | |
| SCHEMBL3337880 | 0.88 | TRIM58 (0.51) | PIK3CATRIM58PIK3CDPIK3CBPIK3CG | |
| SCHEMBL5131263 | 0.86 | KCNH2 (0.44) | PIK3CAKCNH2HTR4TRIM58HTR2A | |
| SCHEMBL3336361 | 0.83 | MOK (0.51) | PIK3CA | |
| SCHEMBL3334893 | 0.82 | MAPK14 (0.49) | PIK3CAKCNH2AVPR1BMAPK13MAPK12 | |
| SCHEMBL5127444 | 0.81 | AVPR1B (0.39) | NPC1PIK3CAKCNH2HTR4TRIM58 | |
| SCHEMBL3332780 | 0.78 | ACHE (0.48) | KITPIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL3341092 | 0.78 | ACHE (0.48) | KITPIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL3340207 | 0.78 | KIT (0.55) | KITNPC1ADORA2ALRRK2 | |
| SCHEMBL3341513 | 0.77 | ACHE (0.48) | KITPIK3CAPIK3CDPIK3CBPIK3CG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008009077-A2 | 4,6-DL- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING VIRAL INFECTIONS | GILEAD SCIENCES, INC. (US) | 2008-01-24 | — | — | WO | claimed |