Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 3/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9334142 | 0.86 | GRM5 (0.38) | FEN1ALOX5APCTSLCTSSCTSK | |
| SCHEMBL9335264 | 0.85 | CYP1A1 (0.42) | CTSLCTSSCTSKCYP1A1CYP1A2 | |
| SCHEMBL9334205 | 0.83 | CYP1A1 (0.40) | CTSLCTSSCTSKCYP1A1CYP1A2 | |
| SCHEMBL10303390 | 0.79 | RAB9A (0.41) | FEN1ALOX5APCTSLCTSSCTSK | |
| SCHEMBL9333793 | 0.78 | CTSL (0.37) | FEN1ALOX5APCTSLCTSSCTSK | |
| SCHEMBL9334032 | 0.77 | CYP1A1 (0.40) | CTSLCTSSCTSKCYP1A1CYP1A2 | |
| SCHEMBL10303288 | 0.76 | RAB9A (0.38) | FEN1ALOX5APCTSLCTSSCTSK | |
| SCHEMBL9335371 | 0.76 | CYP1A1 (0.39) | CTSLCTSSCTSKCYP1A1CYP1A2 | |
| SCHEMBL9419245 | 0.75 | CCR1 (0.44) | FEN1ALOX5APCTSLCTSSCTSK | |
| SCHEMBL9335289 | 0.75 | TSHR (0.40) | CTSLCTSSCTSKCYP1A1CYP1A2 |
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 |