Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.55 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9340880 | 1.00 | ESR1 (0.55) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL28411160 | 0.90 | MAPT (0.58) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL8956804 | 0.89 | MAPT (0.56) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL5373240 | 0.89 | MAPT (0.59) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL28965906 | 0.87 | ESR1 (0.56) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL28965919 | 0.87 | ESR1 (0.56) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL28965942 | 0.87 | ESR1 (0.56) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL7864534 | 0.84 | MAPT (0.61) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL8751863 | 0.84 | ALDH1A1 (0.54) | ESR1LMNATSHRCYP1A2CYP2D6 | |
| SCHEMBL6872338 | 0.84 | ALDH1A1 (0.54) | ESR1LMNATSHRCYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5324451-A | Excellent response and memory | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1994-06-28 | — | — | US | disclosed |
| EP-0329153-B1 | NOVEL LACTIC ACID DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THE SAME | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1992-10-21 | — | — | EP | disclosed |
| EP-0329153-A2 | Novel lactic acid derivatives and liquid crystal compositions containing the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1989-08-23 | — | — | EP | disclosed |