Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.43 |
| ▸ | CHRNG | P07510 | 1/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | CHRND | Q07001 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9745320 | 0.92 | ESR1 (0.42) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL9221209 | 0.88 | CES2 (0.46) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL9219903 | 0.82 | CHRNA1 (0.55) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL4526065 | 0.79 | ALDH1A1 (0.59) | CES2CES1SLC6A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL7009800 | 0.78 | PIM1 (0.40) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL8172221 | 0.77 | LMNA (0.59) | SLC6A2SLC6A3SMN1; SMN2GAAALDH1A1 | |
| SCHEMBL4714984 | 0.77 | KCNQ3 (0.38) | SLC6A2SLC6A3SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL9227046 | 0.76 | CHRNA1 (0.58) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL9226597 | 0.75 | CES2 (0.54) | CES2CES1SLC6A2CHRNA1CHRNG | |
| SCHEMBL10630786 | 0.73 | HDAC1 (0.42) | CES2CES1SMN1; SMN2ALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0303291-B1 | Fluorinated benzoyl compounds | ASAHI GLASS CO LTD (JP) | 1995-04-26 | — | — | EP | disclosed |
| US-5068449-A | FLUORINATED BENZOYL COMPOUNDS | ASAHI GLASS COMPANY, LTD. (JP) | 1991-11-26 | — | — | US | disclosed |
| EP-0303291-A2 | Fluorinated benzoyl compounds | ASAHI GLASS COMPANY LTD. (JP) | 1989-02-15 | — | — | EP | disclosed |