Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.38 |
| ▸ | GRM6 | O15303 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL4595807 | 0.82 | MEN1 (0.42) | MEN1KMT2AALDH1A1ALOX5CYP3A4 | |
| SCHEMBL2211394 | 0.74 | TSHR (0.48) | MEN1KMT2AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL2209882 | 0.71 | TSHR (0.40) | MEN1KMT2AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL956546 | 0.65 | MEN1 (0.48) | MEN1KMT2AALDH1A1ALOX5 | |
| SCHEMBL4595422 | 0.65 | FFAR1 (0.42) | ACP3UTS2RAKR1C3AKR1C2FFAR1 | |
| SCHEMBL28656346 | 0.64 | NPSR1 (0.46) | ACP3ALDH1A1NPC1RAB9AALOX5 | |
| SCHEMBL2067078 | 0.63 | NPSR1 (0.38) | MEN1KMT2AACP3NPC1RAB9A | |
| SCHEMBL15209900 | 0.63 | LDHA (0.50) | MEN1KMT2AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL9855895 | 0.62 | NPSR1 (0.51) | KMT2AACP3ALDH1A1NPC1RAB9A | |
| SCHEMBL21798482 | 0.61 | ALOX5 (0.54) | MEN1KMT2AACP3ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7981874-B2 | Phosphorus derivatives as histone deacetylase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2011-07-19 | — | — | US | disclosed |