Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.69 |
| ▸ | RAB9A | P51151 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11742493 | 0.92 | NPC1 (0.67) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL7868896 | 0.87 | NPC1 (0.83) | NPC1RAB9AMAPTPDE4BLMNA | |
| SCHEMBL2522956 | 0.84 | NPC1 (0.59) | NPC1RAB9AKMT2AMAPTLMNA | |
| SCHEMBL1304210 | 0.82 | NPC1 (1.00) | NPC1RAB9AKMT2AMAPTPDE4B | |
| SCHEMBL28650786 | 0.81 | LMNA (0.76) | NPC1RAB9AKMT2AMAPTPDE4B | |
| SCHEMBL11436374 | 0.81 | NPC1 (0.73) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL7367952 | 0.81 | RAB9A (0.68) | NPC1RAB9AKMT2AMAPTLMNA | |
| SCHEMBL1304164 | 0.79 | NPC1 (0.71) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL656856 | 0.79 | NPC1 (0.71) | NPC1RAB9AKMT2AMAPTPDE4B | |
| SCHEMBL4096780 | 0.79 | NPC1 (0.71) | NPC1RAB9AKMT2AMAPTPDE4B |
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-1204636-A1 | 3-OXOPROPANE-1-SULPHONIC ACIDS AND SULPHONATES | DSM N.V. (NL) | 2002-05-15 | — | — | EP | disclosed |
| WO-2001014327-A1 | 3-OXOPROPANE-1-SULPHONIC ACIDS AND SULPHONATES | DSM N.V. (NL) | 2001-03-01 | — | — | WO | disclosed |