Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 2/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | SCD | O00767 | 4/20 | 0.44 |
| ▸ | SCD5 | Q86SK9 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM5C | P41229 | 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 | |
|---|---|---|---|---|
| SCHEMBL2852927 | 0.94 | KLKB1 (0.50) | KLKB1NPC1RAB9AL3MBTL1ALDH1A1 | |
| SCHEMBL2848515 | 0.93 | LMNA (0.50) | KLKB1NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL2861622 | 0.91 | EPHX1 (0.60) | EPHX1L3MBTL1SMN1; SMN2 | |
| SCHEMBL2853080 | 0.88 | LMNA (0.50) | KLKB1NPC1RAB9AL3MBTL1SCD5 | |
| SCHEMBL2852519 | 0.87 | TAAR1 (0.59) | KLKB1NPC1RAB9AL3MBTL1HDAC3 | |
| SCHEMBL2859721 | 0.87 | KLKB1 (0.49) | KLKB1RAB9AL3MBTL1SCDSCD5 | |
| SCHEMBL2860989 | 0.84 | ALDH1A1 (0.68) | NPC1RAB9ASCD5ALDH1A1SMN1; SMN2 | |
| SCHEMBL2859353 | 0.82 | TAAR1 (0.66) | NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18544527 | 0.81 | KLKB1 (0.68) | KLKB1 | |
| SCHEMBL2852630 | 0.81 | TAAR1 (0.52) | NPC1RAB9AALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |