Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 11/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16197363 | 0.81 | CYP2D6 (0.52) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL8880097 | 0.79 | CYP3A4 (0.43) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL8881966 | 0.79 | POLB (0.49) | CYP3A4MEN1KMT2AALDH1A1OPRM1 | |
| SCHEMBL1290767 | 0.77 | CYP2D6 (0.49) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL9233359 | 0.74 | POLB (0.54) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL9228415 | 0.72 | ALDH1A1 (0.58) | CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL9232502 | 0.72 | CYP2D6 (0.47) | CYP2D6CYP3A4TSHRALDH1A1SIGMAR1 | |
| SCHEMBL9566488 | 0.71 | CYP2D6 (0.48) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL8883321 | 0.70 | POLB (0.49) | CYP2D6CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL8881229 | 0.70 | HRH3 (0.47) | CYP2D6CYP3A4TSHRMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5677316-A | BACTERICIDES | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-10-14 | — | — | US | disclosed |
| EP-0677522-A1 | 8-METHOXYQUINOLONECARBOXYLIC ACID DERIVATIVE | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-10-18 | — | — | EP | disclosed |