Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 5/20 | 0.35 |
| ▸ | PRKCA | P17252 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10434848 | 0.93 | RARB (0.42) | TSHRCNR2RARBTP53 | |
| SCHEMBL27989443 | 0.82 | THRB (0.38) | TSHRLMNACNR2ALDH1A1CHRM1 | |
| SCHEMBL10596237 | 0.81 | NR5A1 (0.38) | CYP2C19CHRM1TDP1RARBNR5A1 | |
| SCHEMBL10596280 | 0.81 | NR5A1 (0.38) | CYP2C19CHRM1TDP1RARBNR5A1 | |
| SCHEMBL10526390 | 0.81 | RARB (0.42) | ALDH1A1MAPTRARB | |
| SCHEMBL10448680 | 0.77 | RARB (0.47) | TSHRLMNASMN1; SMN2NPC1RARB | |
| SCHEMBL10598385 | 0.76 | USP2 (0.35) | CYP1A2CYP2D6MAPK1CYP2C19ALDH1A1 | |
| SCHEMBL5828435 | 0.76 | CHRM2 (0.39) | TSHRLMNAMAPK1CYP2C19CNR2 | |
| SCHEMBL4186206 | 0.76 | CHRM2 (0.39) | TSHRLMNAMAPK1CYP2C19CNR2 | |
| SCHEMBL11363524 | 0.76 | CHRM2 (0.39) | TSHRLMNAMAPK1CYP2C19CNR2 |
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-0376294-A1 | Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions | HITACHI, LTD. (JP) | 1990-07-04 | — | — | EP | disclosed |