Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 4/20 | 0.47 |
| ▸ | CES1 | P23141 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.43 |
| ▸ | NAAA | Q02083 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL28438991 | 0.81 | MEN1 (0.54) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL23869396 | 0.81 | ALDH1A1 (0.49) | CES2CES1MEN1KMT2AALDH1A1 | |
| SCHEMBL593911 | 0.80 | NAAA (0.55) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL593910 | 0.80 | NPSR1 (0.50) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL27666438 | 0.80 | NPSR1 (0.50) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL3632556 | 0.79 | LMNA (0.50) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL10872342 | 0.79 | NPSR1 (0.49) | NPSR1CES2CES1KDM4EMEN1 | |
| Valeric Acid SCHEMBL29010093 | 0.79 | NPSR1 (0.49) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL10893018 | 0.79 | SRC (0.55) | NPSR1CES2CES1KDM4EMEN1 | |
| SCHEMBL330531 | 0.79 | CES2 (0.52) | NPSR1CES2CES1KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101341127-A | 4,5-dihydro- (1H)-pyrazole derivatives as cannabinoid CB1 receptor modulators | SOLVAY PHARM BV (NL) | 2009-01-07 | — | — | CN | disclosed |