Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 7/20 | 0.61 |
| ▸ | RXRA | P19793 | 1/20 | 0.61 |
| ▸ | RXRB | P28702 | 1/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.50 |
| ▸ | XBP1 | P17861 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3769260 | 0.83 | HPGD (0.71) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL3047774 | 0.81 | HPGD (0.69) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL1749470 | 0.76 | RXRA (1.00) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL31556117 | 0.75 | HPGD (0.61) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL9260073 | 0.75 | CA12 (0.72) | HPGDHDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10823263 | 0.75 | ACP1 (0.49) | HPGDRXRARXRBMEN1KMT2A | |
| SCHEMBL2037499 | 0.74 | HPGD (0.60) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL15331520 | 0.74 | HPGD (0.60) | HPGDRXRARXRBHDAC6MEN1 | |
| SCHEMBL1988682 | 0.74 | PTGER1 (0.60) | — | |
| SCHEMBL7108878 | 0.73 | CA12 (0.74) | HPGDHDAC6MEN1KMT2ANPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1861079-A1 | ARYLSULFONYL BENZYL ETHERS AS 5-HT2A ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006097766-A1 | ARYLSULFONYL BENZYL ETHERS AS 5-HT2A ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 2006-09-21 | — | — | WO | disclosed |