Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | VDR | P11473 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | WHR1 | P49842 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9607686 | 0.83 | POLB (0.43) | NR1I3CYP1A2CYP3A4VDRCYP2C9 | |
| SCHEMBL8779209 | 0.81 | POLB (0.49) | NR1I3CYP1A2CYP3A4VDRCYP2C9 | |
| SCHEMBL8779280 | 0.74 | PDE10A (0.42) | NR1I3POLBRAB9ASMN1; SMN2MAPT | |
| SCHEMBL8779590 | 0.70 | MAPT (0.51) | NR1I3CYP1A2CYP3A4VDRCYP2C9 | |
| SCHEMBL3787452 | 0.69 | PDE10A (0.54) | CYP1A2POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10697834 | 0.67 | L3MBTL1 (0.57) | POLBRAB9ASMN1; SMN2MAPTGAA | |
| SCHEMBL8779307 | 0.67 | KDM4E (0.49) | NR1I3CYP1A2CYP3A4VDRCYP2C9 | |
| SCHEMBL8779566 | 0.67 | ABCG2 (0.48) | NR1I3CYP1A2CYP3A4VDRCYP2C9 | |
| SCHEMBL3795393 | 0.66 | PDE10A (0.42) | NR1I3POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8776938 | 0.66 | PDE10A (0.51) | CYP1A2POLBNPC1RAB9ASMN1; SMN2 |
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-2010136475-A1 | SUBSTITUTED QUINAZOLINES AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2010-12-02 | — | — | WO | disclosed |