Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 3/20 | 0.38 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | MAX | P61244 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.35 |
| ▸ | CHRNG | P07510 | 2/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9160449 | 0.81 | SLC6A3 (0.46) | SLC6A2SLC6A3SLC6A4HDAC1HDAC2 | |
| SCHEMBL28031956 | 0.80 | CHRNA1 (0.49) | SLC6A2SLC6A3CHRNA1CHRNGCHRNB1 | |
| SCHEMBL27729501 | 0.80 | CES2 (0.61) | SLC6A2SLC6A3CES2CES1CHRNA1 | |
| SCHEMBL11602395 | 0.78 | TSHR (0.48) | CES2CES1F2HRH1KCNH2 | |
| SCHEMBL19198801 | 0.77 | SLC6A2 (0.50) | SLC6A2SLC6A3SLC6A4HDAC1HDAC2 | |
| SCHEMBL8752498 | 0.75 | TSHR (0.51) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7912423 | 0.75 | CA2 (0.46) | F2 | |
| SCHEMBL281 | 0.73 | TSHR (0.57) | HDAC1HDAC2GRM5ALDH1A1SMN1; SMN2 | |
| SCHEMBL7451795 | 0.73 | TSHR (0.57) | HDAC1HDAC2GRM5ALDH1A1SMN1; SMN2 | |
| SCHEMBL29732178 | 0.73 | TSHR (0.57) | HDAC1HDAC2GRM5ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0639049-A1 | HALOGENATED 4'-METHOXYACETOPHENONES AS MICROBICIDES AND PRESERVATIVES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1995-02-22 | — | — | EP | disclosed |
| WO-1993022918-A1 | HALOGENATED 4'-METHOXYACETOPHENONES AS MICROBICIDES AND PRESERVATIVES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1993-11-25 | — | — | WO | disclosed |