Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PPID | Q08752 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4196740 | 0.91 | ALDH1A1 (0.41) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL4196745 | 0.91 | ALDH1A1 (0.41) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL4192209 | 0.90 | ALDH1A1 (0.40) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL5188655 | 0.90 | ALDH1A1 (0.40) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL4192216 | 0.90 | ALDH1A1 (0.40) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL2311421 | 0.89 | ALDH1A1 (0.43) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL2311414 | 0.89 | ALDH1A1 (0.43) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL4208000 | 0.88 | F10 (0.39) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL4207996 | 0.88 | F10 (0.39) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 | |
| SCHEMBL14231825 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HSD17B10LMNAPOLBL3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6114328-A | ANTICOAGULANTS; BLOOD DISORDERS | DUPONT PHARMACEUTICALS COMPANY (US) | 2000-09-05 | — | — | US | disclosed |
| EP-0970950-A2 | Novel isoxazoline and isoxazole fibrinogen receptor antagonists | DuPont Pharmaceuticals Company (US) | 2000-01-12 | — | — | EP | disclosed |
| US-5849736-A | Isoxazoline and isoxazole fibrinogen receptor antagonists | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-12-15 | — | — | US | disclosed |
| WO-1995014683-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-06-01 | — | — | WO | disclosed |