Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 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 | |
|---|---|---|---|---|
| SCHEMBL8655169 | 0.96 | MAOB (0.35) | CYP1A2MAPK1SMN1; SMN2MAOBDAO | |
| SCHEMBL8660892 | 0.90 | CYP1A2 (0.33) | CYP1A2MAPK1SMN1; SMN2MAOB | |
| SCHEMBL8657068 | 0.89 | MAOB (0.33) | SMN1; SMN2MAOBDAOHTR4 | |
| SCHEMBL8658466 | 0.88 | CYP1A2 (0.38) | CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL8655104 | 0.87 | SMN1; SMN2 (0.36) | SMN1; SMN2MAOBDAOHTR4 | |
| SCHEMBL8661603 | 0.85 | MAOB (0.33) | CYP1A2SMN1; SMN2MAOBDAOHTR4 | |
| SCHEMBL8655661 | 0.84 | SMN1; SMN2 (0.38) | CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL8656240 | 0.84 | PKM (0.35) | CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL8655707 | 0.83 | MAPK1 (0.34) | CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL8661783 | 0.83 | GLA (0.31) | DAO |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5776937-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-07-07 | — | — | US | disclosed |