Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 10/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ABCC9 | O60706 | 5/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9195978 | 0.90 | ABCB1 (0.56) | ABCB1CYP3A4ALOX15ABCC9 | |
| SCHEMBL9274025 | 0.85 | ABCB1 (0.45) | ABCB1CYP3A4ALOX15ABCC9RXFP1 | |
| SCHEMBL9274823 | 0.85 | ABCB1 (0.45) | ABCB1CYP3A4ALOX15ABCC9RXFP1 | |
| SCHEMBL9267040 | 0.85 | ABCB1 (0.45) | ABCB1CYP3A4ALOX15ABCC9RXFP1 | |
| SCHEMBL9200212 | 0.82 | KDM4E (0.48) | ABCB1CYP3A4ALOX15ABCC9 | |
| SCHEMBL9195596 | 0.81 | ABCC9 (0.52) | ABCB1CYP3A4ALOX15ABCC9 | |
| SCHEMBL9194242 | 0.76 | TP53 (0.46) | ABCB1ABCC9 | |
| SCHEMBL9195248 | 0.76 | SMN1; SMN2 (0.43) | ABCB1DRD2DRD3 | |
| SCHEMBL9199615 | 0.75 | ABCB1 (0.39) | ABCB1CYP3A4ALOX15ABCC9DRD2 | |
| SCHEMBL9842578 | 0.74 | ABCB1 (0.40) | ABCB1RXFP1DRD2DRD3 |
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-5112839-A | CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-05-12 | — | — | US | disclosed |