Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 4/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7407096 | 0.84 | F2 (0.48) | F2PRSS1 | |
| SCHEMBL7405378 | 0.82 | KMT2A (0.48) | MTNR1AMTNR1BTSHRNPC1RAB9A | |
| SCHEMBL7818207 | 0.75 | F2 (0.47) | MTNR1AMTNR1BL3MBTL1F2PRSS1 | |
| SCHEMBL885015 | 0.62 | MTNR1A (1.00) | MTNR1AMTNR1BL3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL8420346 | 0.62 | F2 (0.48) | L3MBTL1HTTF2PRSS1PRSS2 | |
| SCHEMBL1053081 | 0.57 | MTNR1A (0.69) | MTNR1AMTNR1BL3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL3446802 | 0.57 | MTNR1A (0.73) | MTNR1AMTNR1BL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL13939838 | 0.57 | GPR84 (0.47) | MTNR1AMTNR1BL3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL23279842 | 0.57 | F2 (0.53) | F2PRSS1PRSS2PRSS3 | |
| SCHEMBL8115271 | 0.56 | GBA1 (0.40) | GPR84BRAFCYP3A4CYP2D6AURKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0900207-A1 | PYRAZINONE THROMBIN INHIBITORS | Merck & Co., Inc. (US) | 1999-03-10 | — | — | EP | disclosed |
| WO-1997040024-A1 | PYRAZINONE THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 1997-10-30 | — | — | WO | disclosed |