Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200786 | 0.92 | TSHR (0.41) | TSHRHDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL14229228 | 0.85 | TSHR (0.53) | TSHRHDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL14200780 | 0.83 | HDAC6 (0.48) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200903 | 0.82 | RIPK1 (0.49) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200828 | 0.80 | HDAC3 (0.45) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200343 | 0.80 | CNR2 (0.54) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200916 | 0.80 | GRIN2D (0.48) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200849 | 0.79 | PSEN1 (0.38) | TSHRALDH1A1BLMSMN1; SMN2SIGMAR1 | |
| SCHEMBL23992462 | 0.78 | HDAC6 (0.51) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14229892 | 0.77 | ALDH1A1 (0.47) | TSHRHDAC1HDAC6HDAC3HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |