Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.64 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.64 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 6/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | GRM5 | P41594 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.56 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.56 |
| ▸ | AHR | P35869 | 2/20 | 0.56 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.56 |
| ▸ | VDR | P11473 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL23996434 | 0.87 | METAP1 (0.59) | ABCB1ABCG2MAPTNPSR1ALDH1A1 | |
| SCHEMBL24589752 | 0.86 | METAP1 (0.57) | ABCB1ABCG2MAPTNPSR1ALDH1A1 | |
| SCHEMBL8816575 | 0.85 | ADORA2A (0.62) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL8819286 | 0.85 | ADORA2A (0.62) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL8817283 | 0.84 | ADORA2A (0.67) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL8815504 | 0.84 | ADORA2A (0.60) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL6121390 | 0.83 | ADORA2A (0.62) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL6120334 | 0.83 | ADORA2A (0.62) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL8819077 | 0.83 | ADORA2A (0.56) | ABCB1ABCG2ADORA2AMAPTALDH1A1 | |
| SCHEMBL2913642 | 0.83 | METAP1 (0.64) | MAPTNPSR1ALDH1A1NPC1RAB9A |
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-2012066122-A1 | 2 - (PYRIDIN- 2 -YL) -QUINAZOLINE DERIVATIVES AND THEIR USE AS MICROBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-05-24 | — | — | WO | disclosed |