Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.35 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.35 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | POLA1 | P09884 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13538038 | 0.96 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL13948785 | 0.94 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL8230419 | 0.94 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL22117295 | 0.84 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL7360782 | 0.82 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL16925547 | 0.78 | ABCC4 (0.59) | ALDH1A1LMNAMAPTABCC4TSHR | |
| SCHEMBL515390 | 0.78 | ALDH1A1 (0.96) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL8229180 | 0.76 | ALDH1A1 (0.51) | ALDH1A1LMNAMAPTABCC4RECQL | |
| SCHEMBL2361759 | 0.76 | TSHR (0.50) | ALDH1A1LMNAMAPTRECQLTSHR | |
| SCHEMBL196188 | 0.76 | LMNA (1.00) | ALDH1A1LMNAMAPTABCC4RECQL |
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 |
|---|---|---|---|---|---|---|---|
| US-5539104-A | 1,4 Diazocines as fibrinogen antagonists | SMITHKLINE BEECHAM CORP. (US) | 1996-07-23 | — | — | US | disclosed |
| EP-0610432-A1 | C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-08-17 | — | — | EP | disclosed |
| WO-1993009133-A1 | C8-CYCLIC PEPTIDOMIMETICS AS FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-05-13 | — | — | WO | disclosed |