Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 5/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | PTGES | O14684 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9334205 | 0.86 | CYP1A1 (0.40) | CTSLCTSSCTSK | |
| SCHEMBL9337514 | 0.86 | FEN1 (0.37) | L3MBTL1KDM4EALDH1A1HPGDHTT | |
| SCHEMBL9333793 | 0.85 | CTSL (0.37) | KDM4EALDH1A1HPGDHTTCTSL | |
| SCHEMBL9335264 | 0.85 | CYP1A1 (0.42) | HTTCTSLCTSSCTSKRAB9A | |
| SCHEMBL9334018 | 0.82 | RAB9A (0.41) | GRM5L3MBTL1KDM4EALDH1A1HPGD | |
| SCHEMBL9334099 | 0.80 | SMN1; SMN2 (0.47) | GRM5L3MBTL1KDM4EALDH1A1HPGD | |
| SCHEMBL9337477 | 0.77 | CYP1A1 (0.37) | HTTCTSLCTSSCTSKTP53 | |
| SCHEMBL9334032 | 0.77 | CYP1A1 (0.40) | CTSLCTSSCTSKHSD17B10 | |
| SCHEMBL9335371 | 0.76 | CYP1A1 (0.39) | HTTCTSLCTSSCTSKTP53 | |
| SCHEMBL9335289 | 0.75 | TSHR (0.40) | ALDH1A1HTTCTSLCTSSCTSK |
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 |