Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9228793 | 0.93 | CHRM2 (0.47) | CHRM2CHRM3OPRM1CTSSCTSK | |
| SCHEMBL9234501 | 0.86 | CHRM2 (0.46) | CHRM2CHRM3CTSSCTSKALDH1A1 | |
| SCHEMBL9233113 | 0.84 | CHRM2 (0.50) | CHRM2CHRM3OPRM1ALDH1A1CYP2D6 | |
| SCHEMBL9232468 | 0.81 | CHRM2 (0.53) | CHRM2CHRM3OPRM1ALDH1A1ACHE | |
| SCHEMBL9228402 | 0.80 | ACHE (0.46) | CHRM2CHRM3OPRM1CTSSCTSK | |
| SCHEMBL2331319 | 0.79 | OPRM1 (0.61) | OPRM1ALDH1A1CYP2D6SIGMAR1ACHE | |
| SCHEMBL5674633 | 0.78 | OPRM1 (0.57) | OPRM1ALDH1A1CYP2D6SIGMAR1OPRL1 | |
| SCHEMBL9232318 | 0.77 | CYP3A4 (0.56) | CHRM2CHRM3OPRM1ALDH1A1CYP2D6 | |
| SCHEMBL5671761 | 0.75 | OPRM1 (0.53) | OPRM1ALDH1A1CYP2D6SIGMAR1OPRL1 | |
| SCHEMBL9234493 | 0.74 | CYP2D6 (0.48) | CHRM2CHRM3ALDH1A1CYP2D6ACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0677522-A1 | 8-METHOXYQUINOLONECARBOXYLIC ACID DERIVATIVE | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-10-18 | — | — | EP | disclosed |