Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7968303 | 0.84 | SCN9A (0.36) | GPBAR1CYP3A4TSHRGAAGSK3B | |
| SCHEMBL7971714 | 0.82 | CA1 (0.36) | L3MBTL1 | |
| SCHEMBL7968051 | 0.81 | HSP90AA1 (0.44) | L3MBTL1HSP90AA1HSP90AB1MAPTGAA | |
| SCHEMBL7958876 | 0.78 | CHRM5 (0.37) | GPBAR1JAK2 | |
| SCHEMBL7971895 | 0.77 | CYP3A4 (0.36) | GPBAR1L3MBTL1CYP3A4TSHRGSK3B | |
| SCHEMBL28115232 | 0.76 | EGFR (0.40) | GPBAR1L3MBTL1CYP3A4MAPTGRM5 | |
| SCHEMBL7971991 | 0.74 | KMO (0.38) | GPBAR1CYP3A4TSHRGSK3B | |
| Ammonia Solution, Strong SCHEMBL5380432 | 0.70 | ALDH1A1 (0.55) | L3MBTL1HSP90AA1HSP90AB1KDM4ETDP1 | |
| SCHEMBL7969462 | 0.69 | HSD17B14 (0.34) | L3MBTL1CYP3A4TSHRGAANFE2L2 | |
| SCHEMBL7969127 | 0.68 | KDM4E (0.36) | L3MBTL1CYP3A4TSHRKDM4EJAK2 |
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-2001017965-A2 | CYANOPIPERIDINES AS PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2001-03-15 | — | — | WO | disclosed |