Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | NCEH1 | Q6PIU2 | 4/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5343019 | 0.86 | PTPN1 (0.44) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL5809067 | 0.85 | HDAC6 (0.39) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL5340323 | 0.83 | HDAC6 (0.37) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL5337091 | 0.64 | RXFP1 (0.46) | ESR1TNFRSF1AALDH1A1PTPN1 | |
| SCHEMBL19029351 | 0.60 | HDAC6 (0.83) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL5341289 | 0.60 | APP (0.39) | HDAC2TNFRSF1APTPN1 | |
| SCHEMBL7772381 | 0.59 | MEN1 (0.51) | NCEH1ALDH1A1 | |
| SCHEMBL16284864 | 0.59 | SMN1; SMN2 (0.66) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL13302341 | 0.58 | ERN1 (0.56) | HDAC2ESR1ESR2 | |
| SCHEMBL8459958 | 0.58 | HDAC6 (0.50) | HDAC6HDAC3HDAC1HDAC2HDAC8 |
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-1664015-A1 | SUBSTITUTED NAPHTHYL BENZOTHIOPHENE ACIDS | Wyeth (US) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005030750-A1 | SUBSTITUTED NAPHTHYL BENZOTHIOPHENE ACIDS | WYETH (US) | 2005-04-07 | — | — | WO | disclosed |