Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14879952 | 1.00 | CYP3A4 (0.35) | CYP3A4MAPTRECQLIDO1CYP19A1 | |
| SCHEMBL31410914 | 0.82 | PTPN1 (0.35) | CYP3A4MAPTRECQLIDO1 | |
| SCHEMBL11797090 | 0.82 | PTPN1 (0.35) | CYP3A4MAPTRECQLIDO1 | |
| Methane SCHEMBL28757480 | 0.80 | PTPN1 (0.34) | CYP3A4MAPTRECQLIDO1 | |
| SCHEMBL15874272 | 0.79 | CYP3A4 (0.36) | CYP3A4MAPTRECQL | |
| SCHEMBL14879887 | 0.76 | UGT2B7 (0.33) | CYP3A4MAPTRECQL | |
| SCHEMBL14879886 | 0.76 | UGT2B7 (0.33) | CYP3A4MAPTRECQL | |
| SCHEMBL18835579 | 0.76 | UGT2B7 (0.33) | CYP3A4MAPTRECQL | |
| SCHEMBL14879850 | 0.72 | SMN1; SMN2 (0.37) | MAPT | |
| SCHEMBL15874150 | 0.71 | — | — |
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-9499464-B2 | Opsin-binding ligands, compositions and methods of use | BIKAM PHARMACEUTICALS, INC. (US) | 2016-11-22 | — | — | US | claimed |