Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8881539 | 0.96 | NPSR1 (0.41) | ALDH1A1LMNATSHRMAPK1NPC1 | |
| SCHEMBL8881874 | 0.88 | RAB9A (0.40) | ALDH1A1LMNANPC1CASP3CYP3A4 | |
| SCHEMBL9233372 | 0.88 | KDM4E (0.41) | ALDH1A1LMNANPC1CASP3CYP3A4 | |
| SCHEMBL8881736 | 0.88 | CASP3 (0.46) | ALDH1A1LMNASLC6A4CASP3CYP3A4 | |
| SCHEMBL8882202 | 0.85 | CASP3 (0.46) | ALDH1A1LMNASLC6A4CASP3CYP3A4 | |
| SCHEMBL9231209 | 0.85 | CYP3A4 (0.41) | ALDH1A1LMNACASP3CYP3A4CYP2D6 | |
| SCHEMBL9232448 | 0.85 | OPRM1 (0.47) | ALDH1A1CASP3CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8881749 | 0.82 | NPSR1 (0.43) | LMNACYP2D6CYP2C9CYP2C19OPRM1 | |
| SCHEMBL8882513 | 0.80 | CASP3 (0.47) | ALDH1A1LMNACASP3CYP3A4CYP2D6 | |
| SCHEMBL9230909 | 0.78 | CYP3A4 (0.46) | ALDH1A1LMNASLC6A4CASP3CYP3A4 |
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 |