Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 9/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 8/20 | 0.48 |
| ▸ | CA1 | P00915 | 8/20 | 0.48 |
| ▸ | CA9 | Q16790 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | CA5A | P35218 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5181975 | 0.96 | CYP2D6 (0.57) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL31252904 | 0.96 | CYP2D6 (0.57) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL7609456 | 0.95 | CYP2D6 (0.59) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL10495764 | 0.95 | CYP2D6 (0.55) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL13528393 | 0.95 | CYP2D6 (0.59) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL2927855 | 0.92 | CYP2D6 (0.53) | CYP2D6HSD17B10THRBCA2NR3C1 | |
| SCHEMBL10360215 | 0.91 | CYP2D6 (0.60) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL22083616 | 0.91 | CYP2D6 (0.60) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL12920549 | 0.91 | CYP2D6 (0.52) | CYP2D6HSD17B10THRBCA2TSHR | |
| SCHEMBL16126900 | 0.90 | CYP2D6 (0.55) | CYP2D6HSD17B10THRBCA2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-4273889-A | — | — | None | — | — | JP | disclosed |
| JP-H04273889-A | SECCHARIDE DERIVATIVE AND ITS PRODUCTION | DAINIPPON INK & CHEM INC | 1992-09-30 | — | — | JP | disclosed |