Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | MPL | P40238 | 2/20 | 0.32 |
| ▸ | CHKA | P35790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9335371 | 0.96 | CYP1A1 (0.39) | CYP1A1CYP1A2CYP1B1TYRTSHR | |
| SCHEMBL9335289 | 0.95 | TSHR (0.40) | CYP1A1CYP1A2CYP1B1TYRTSHR | |
| SCHEMBL9337477 | 0.94 | CYP1A1 (0.37) | CYP1A1CYP1A2CYP1B1TYRTSHR | |
| SCHEMBL9335264 | 0.92 | CYP1A1 (0.42) | CYP1A1CYP1A2CYP1B1CTSLCTSS | |
| SCHEMBL9334205 | 0.90 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1CTSLCTSS | |
| SCHEMBL9335277 | 0.86 | TSHR (0.44) | CYP1A1CYP1A2CYP1B1TSHRHSD17B10 | |
| SCHEMBL10302715 | 0.83 | MPL (0.34) | TYRCTSLCTSSCTSKMPL | |
| SCHEMBL9333976 | 0.82 | HSD17B10 (0.50) | TSHRHSD17B10MPL | |
| SCHEMBL10302816 | 0.82 | FFAR1 (0.40) | TYRMPL | |
| SCHEMBL9333304 | 0.81 | HSD17B10 (0.52) | TSHRHSD17B10 |
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-5328637-A | Electrooptical devices; deformation of aligned phases and supertwisted nematic applications; miscibility, solubility | HOFFMANN-LA ROCHE INC. (US) | 1994-07-12 | — | — | US | disclosed |