Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229430 | 0.91 | HDAC6 (0.54) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14200898 | 0.84 | HDAC1 (0.40) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14229280 | 0.81 | RIPK1 (0.48) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14229892 | 0.81 | ALDH1A1 (0.47) | HDAC1HDAC6HDAC3HDAC2NCOR2 | |
| SCHEMBL14228983 | 0.81 | GRIN2D (0.49) | POLBAPEX1TDP1TP53GRIN2D | |
| SCHEMBL14229047 | 0.78 | APP (0.50) | TP53ALDH1A1HTTKMT2AHPGD | |
| SCHEMBL14228970 | 0.78 | SMN1; SMN2 (0.37) | POLBTP53ALDH1A1KMT2ALMNA | |
| SCHEMBL14229924 | 0.77 | TAS1R3 (0.39) | POLBTP53ALDH1A1KMT2ALMNA | |
| SCHEMBL14228962 | 0.77 | TRPM8 (0.39) | POLBALDH1A1KMT2ALMNALTB4R2 | |
| SCHEMBL14200780 | 0.76 | HDAC6 (0.48) | HDAC1HDAC6HDAC3HDAC2NCOR2 |
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 |