Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7361660 | 0.80 | PLCG1 (0.43) | SSTR4L3MBTL1ALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL7371863 | 0.76 | ALDH1A1 (0.33) | L3MBTL1ALDH1A1HPGDMAPTKDM4E | |
| SCHEMBL24056365 | 0.68 | AOC3 (0.42) | L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7365114 | 0.67 | AOC3 (0.44) | L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL3081194 | 0.67 | AOC3 (0.43) | L3MBTL1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL13940968 | 0.65 | L3MBTL1 (0.42) | L3MBTL1ALDH1A1 | |
| SCHEMBL24057956 | 0.65 | MAOA (0.37) | L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL13095210 | 0.64 | ALDH1A1 (0.38) | L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL25280262 | 0.64 | MAOA (0.36) | L3MBTL1ALDH1A1HPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL30023372 | 0.64 | MAOA (0.36) | L3MBTL1ALDH1A1HPGDSMN1; SMN2 |
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-1259506-A1 | PYRAZINONE THROMBIN INHIBITORS | Merck & Co., Inc. (US) | 2002-11-27 | — | — | EP | disclosed |
| US-6387911-B1 | Pyrazinone thrombin inhibitors | MERCK & CO., INC. | 2002-05-14 | — | — | US | disclosed |
| WO-2001038323-A1 | PYRAZINONE THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2001-05-31 | — | — | WO | disclosed |