Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | MGAM | O43451 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | SI | P14410 | 3/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.33 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.33 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ACLY | P53396 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8596620 | 0.89 | DCTPP1 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4MGAM | |
| SCHEMBL8598378 | 0.86 | PTAFR (0.33) | GAAMAPTMAPK1 | |
| SCHEMBL8600729 | 0.85 | KDM4E (0.32) | GAACYP2D6KDM4EMAPT | |
| SCHEMBL8600971 | 0.85 | CYP2D6 (0.40) | MGAMGAASIMGAM2DCTPP1 | |
| SCHEMBL8602518 | 0.80 | SQOR (0.32) | CHRNB2CHRNB4CHRNA3CHRNA4MGAM | |
| SCHEMBL8603587 | 0.80 | — | — | |
| SCHEMBL8600308 | 0.80 | PTAFR (0.32) | — | |
| SCHEMBL8597508 | 0.80 | SQOR (0.32) | CHRNB2CHRNB4CHRNA3CHRNA4MGAM | |
| SCHEMBL7556309 | 0.78 | RARB (0.40) | GAADCTPP1CYP2D6KDM4EALDH1A1 | |
| SCHEMBL7560574 | 0.77 | RARB (0.39) | GAADCTPP1CYP2D6KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |