Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MLYCD | O95822 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2859060 | 0.89 | ALDH1A1 (0.46) | KDM4ENPSR1MLYCDCYP1A2CYP3A4 | |
| SCHEMBL2861199 | 0.83 | AOC3 (0.49) | — | |
| SCHEMBL2857918 | 0.81 | CCR1 (0.54) | CCR1MLYCDNPC1KMT2AMEN1 | |
| SCHEMBL2854621 | 0.78 | TSHR (0.58) | NPC1RAB9AKMT2AMEN1TSHR | |
| SCHEMBL2854535 | 0.74 | SMN1; SMN2 (0.60) | L3MBTL1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL24713417 | 0.74 | MAPK14 (0.66) | KDM4EFAAHL3MBTL1MLYCDKMT2A | |
| SCHEMBL2857889 | 0.74 | NPC1 (0.52) | NPC1RAB9AKMT2AGAA | |
| SCHEMBL24713418 | 0.74 | USP2 (0.62) | KDM4EFAAHMLYCDNPC1RAB9A | |
| SCHEMBL2854225 | 0.73 | CCR1 (0.60) | CCR1KDM4ENPSR1MAPK14 | |
| SCHEMBL24713109 | 0.73 | MLYCD (0.67) | KDM4ENPSR1L3MBTL1MLYCDNPC1 |
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 |