Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7445471 | 0.91 | KEAP1 (0.44) | ALDH1A1HPGDLMNAFAAHKEAP1 | |
| SCHEMBL7437586 | 0.87 | SMN1; SMN2 (0.47) | ALDH1A1HPGDLMNAFAAHCYP1A2 | |
| SCHEMBL7443082 | 0.87 | KCNH2 (0.42) | ALDH1A1HPGDFAAHKCNH2 | |
| SCHEMBL7440966 | 0.82 | KCNH2 (0.46) | ALDH1A1HPGDFAAHKCNH2 | |
| SCHEMBL6783633 | 0.78 | KEAP1 (0.52) | HPGDLMNAKEAP1FFAR1SMN1; SMN2 | |
| SCHEMBL17440498 | 0.78 | KCNH2 (0.38) | ALDH1A1HPGDLMNAFAAHCYP1A2 | |
| SCHEMBL17440751 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HPGDLMNAFAAHCYP1A2 | |
| SCHEMBL28125032 | 0.77 | KEAP1 (0.44) | ALDH1A1HPGDLMNAKEAP1FFAR1 | |
| SCHEMBL1020532 | 0.76 | KCNH2 (0.39) | ALDH1A1HPGDFAAHKCNH2 | |
| SCHEMBL7498125 | 0.75 | TDP1 (0.42) | ALDH1A1LMNAFAAHSMN1; SMN2KCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0677043-A4 | — | — | 1995-11-22 | — | — | EP | disclosed |
| EP-0677043-A1 | PLATELET AGGREGATION INHIBITING COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1995-10-18 | — | — | EP | disclosed |
| WO-1994014775-A1 | PLATELET AGGREGATION INHIBITING COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-07-07 | — | — | WO | disclosed |