Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6837480 | 0.83 | RXFP1 (0.42) | RXFP1NPSR1NPC1ALDH1A1DHODH | |
| SCHEMBL370267 | 0.83 | GSK3A (0.39) | NPSR1ALDH1A1ADORA3MEN1KMT2A | |
| SCHEMBL6837241 | 0.81 | LMNA (0.35) | RXFP1NPSR1ALDH1A1MKNK2ADORA3 | |
| SCHEMBL6837254 | 0.80 | LMNA (0.36) | NPSR1ALDH1A1MKNK2ADORA3KDM4E | |
| SCHEMBL370868 | 0.79 | MKNK2 (0.35) | NPSR1MKNK2ADORA3MEN1KMT2A | |
| SCHEMBL6837114 | 0.79 | MKNK2 (0.42) | RXFP1NPSR1NPC1ALDH1A1DHODH | |
| SCHEMBL370192 | 0.79 | MAPT (0.35) | RXFP1NPSR1ALDH1A1MKNK2MEN1 | |
| SCHEMBL369851 | 0.78 | GSK3A (0.40) | RXFP1NPSR1ALDH1A1MKNK2ADORA3 | |
| SCHEMBL371073 | 0.77 | MAPT (0.34) | RXFP1NPSR1ALDH1A1MKNK2MEN1 | |
| SCHEMBL6837466 | 0.77 | LCK (0.36) | RXFP1NPSR1MKNK2LCKLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012008999-A2 | TRICYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-19 | — | — | WO | disclosed |