Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.51 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.49 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8909683 | 0.89 | HDAC8 (0.53) | ITGB3ITGA2BHDAC8 | |
| SCHEMBL15134022 | 0.82 | HDAC1 (0.62) | HDAC1HDAC6ITGB3ITGA2BPOLB | |
| SCHEMBL9832022 | 0.82 | POLB (0.56) | HDAC1HDAC6POLBCAPN1HDAC8 | |
| SCHEMBL9417356 | 0.82 | HDAC1 (0.56) | HDAC1HDAC6POLBHDAC8 | |
| SCHEMBL5966590 | 0.81 | LPAR1 (0.65) | HDAC1HDAC6ITGB3ITGA2BLPAR1 | |
| SCHEMBL28258933 | 0.80 | ACE (0.57) | HDAC1HDAC6POLBFAAH | |
| SCHEMBL28258931 | 0.80 | ACE (0.57) | HDAC1HDAC6POLBFAAH | |
| SCHEMBL9486035 | 0.80 | HDAC1 (0.70) | HDAC1HDAC6POLBFAAH | |
| SCHEMBL9486027 | 0.80 | HDAC1 (0.70) | HDAC1HDAC6POLBFAAH | |
| SCHEMBL8910628 | 0.80 | KMT2A (0.56) | HDAC1HDAC6ITGB3ITGA2BPOLB |
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-5688946-A | DIPEPTIDES FOR HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS | HOFFMANN LA ROCHE INC. (US) | 1997-11-18 | — | — | US | disclosed |