Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.50 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.46 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5466704 | 0.82 | HSD11B1 (0.50) | HSD11B1PSIP1MAPTALDH1A1LMNA | |
| SCHEMBL402822 | 0.77 | PSIP1 (0.56) | HSD11B1PSIP1MAPTALDH1A1L3MBTL1 | |
| SCHEMBL2870934 | 0.77 | PSIP1 (0.54) | HSD11B1PSIP1MAPTALDH1A1L3MBTL1 | |
| SCHEMBL23690696 | 0.76 | NPC1 (0.52) | HSD11B1PSIP1MAPTALDH1A1LMNA | |
| SCHEMBL6915414 | 0.76 | ALDH1A1 (0.66) | HSD11B1PSIP1MAPTALDH1A1LMNA | |
| SCHEMBL6803055 | 0.75 | HSD11B1 (0.50) | HSD11B1PSIP1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL27534723 | 0.74 | HSD11B1 (0.45) | HSD11B1PSIP1MAPTALDH1A1LMNA | |
| SCHEMBL14403442 | 0.73 | HSD11B1 (0.42) | HSD11B1PSIP1MAPTALDH1A1LMNA | |
| SCHEMBL777601 | 0.73 | PSIP1 (0.67) | HSD11B1PSIP1MAPTALDH1A1L3MBTL1 | |
| SCHEMBL5214593 | 0.73 | MAPT (0.62) | HSD11B1PSIP1MAPTALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102341374-A | SUBSTITUTED 3-AMINO-2-MERCAPTOQUINOLINES AS KCNQ2/3 MODULATORS | GRUENENTHAL GMBH | 2012-02-01 | — | — | CN | disclosed |
| 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 |