Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 11/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | YAP1 | P46937 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7228413 | 0.91 | GRM2 (0.61) | GRM2PTPN1YAP1 | |
| SCHEMBL7229073 | 0.88 | GRM2 (0.45) | GRM2ITGB3ITGA2B | |
| SCHEMBL7913396 | 0.87 | PTPN1 (0.49) | GRM2PTPN1YAP1ITGB3ITGA2B | |
| SCHEMBL7239008 | 0.85 | ITGB3 (0.46) | GRM2PTPN1ITGB3ITGA2B | |
| SCHEMBL7228282 | 0.81 | GRM2 (0.47) | GRM2PTPN1ITGB3ITGA2B | |
| SCHEMBL7228244 | 0.81 | GRM2 (0.50) | GRM2 | |
| SCHEMBL7227808 | 0.81 | GRM2 (0.49) | GRM2ITGB3ITGA2B | |
| SCHEMBL16935712 | 0.80 | CTSS (0.58) | PTPN1NLRP3ITGB3ITGA2B | |
| SCHEMBL2617261 | 0.80 | CTSS (0.58) | PTPN1NLRP3ITGB3ITGA2B | |
| SCHEMBL18920552 | 0.80 | CTSS (0.58) | PTPN1NLRP3ITGB3ITGA2B |
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-6602876-B1 | Adhesion receptor antagonists | MERCK PATENT GMBH (DE) | 2003-08-05 | — | — | US | disclosed |
| US-6204280-B1 | OXAZOLIDINONE DERIVATIVE, ANTICOAGULANT | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKTER HAFTUNG (DE) | 2001-03-20 | — | — | US | disclosed |
| EP-0710657-B1 | Antagonists of adhesion receptors | MERCK PATENT GMBH (DE) | 1998-08-26 | — | — | EP | disclosed |
| EP-0710657-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-08 | — | — | EP | disclosed |