Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.69 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7827419 | 1.00 | HCAR2 (0.69) | HCAR2MAPTALDH1A1CETPALOX5 | |
| SCHEMBL564789 | 0.83 | HCAR2 (1.00) | HCAR2MAPTALDH1A1ALOX5HDAC3 | |
| SCHEMBL7893859 | 0.83 | HCAR2 (1.00) | HCAR2MAPTALDH1A1ALOX5HDAC3 | |
| SCHEMBL660178 | 0.83 | HCAR2 (1.00) | HCAR2MAPTALDH1A1ALOX5HDAC3 | |
| Hydrochloric Acid SCHEMBL9261463 | 0.81 | HCAR2 (0.96) | HCAR2MAPTALDH1A1ALOX5HDAC3 | |
| SCHEMBL10862371 | 0.74 | HCAR2 (0.80) | HCAR2MAPTALDH1A1ALOX5HDAC3 | |
| SCHEMBL9062123 | 0.69 | HCAR2 (0.69) | HCAR2MAPTALDH1A1HDAC3TNKS | |
| SCHEMBL9062121 | 0.69 | HCAR2 (0.69) | HCAR2MAPTALDH1A1HDAC3TNKS | |
| SCHEMBL3513899 | 0.68 | HCAR2 (0.69) | HCAR2MAPTALDH1A1ALOX5PKM | |
| SCHEMBL6832853 | 0.68 | HCAR2 (0.69) | HCAR2MAPTALDH1A1ALOX5PKM |
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 |