Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 4/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | BID | P55957 | 1/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PAM | P19021 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7703558 | 0.84 | HDAC1 (0.58) | MAPK1ALDH1A1L3MBTL1PAMHDAC3 | |
| SCHEMBL25187337 | 0.82 | ALDH1A1 (0.55) | AKR1B1MAPK1ALDH1A1L3MBTL1PAM | |
| SCHEMBL27269053 | 0.81 | ALDH1A1 (0.51) | MPOAKR1B1BIDBCL2L1MCL1 | |
| Phenylacetic Acid SCHEMBL7824936 | 0.80 | AKR1B1 (0.59) | MPOAKR1B1BIDBCL2L1MCL1 | |
| SCHEMBL16797610 | 0.78 | CYP4F2 (0.46) | MPOAKR1B1BIDBCL2L1MCL1 | |
| SCHEMBL10575940 | 0.77 | TDP1 (0.63) | AKR1B1MAPK1ALDH1A1L3MBTL1PAM | |
| SCHEMBL2222140 | 0.77 | HDAC1 (0.67) | MAPK1L3MBTL1HDAC3ADRA1AHDAC4 | |
| SCHEMBL248113 | 0.77 | ALDH1A1 (0.65) | AKR1B1MAPK1ALDH1A1L3MBTL1PAM | |
| SCHEMBL4641515 | 0.76 | ALDH1A1 (0.49) | AKR1B1MAPK1ALDH1A1L3MBTL1PAM | |
| SCHEMBL29046265 | 0.76 | ALDH1A1 (0.49) | AKR1B1MAPK1ALDH1A1L3MBTL1PAM |
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-1091958-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001692-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2000-01-13 | — | — | WO | disclosed |