Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8766242 | 0.86 | ESR1 (0.41) | ESR1ESR2ACHELMNAALOX12 | |
| SCHEMBL2874511 | 0.82 | — | — | |
| SCHEMBL3161976 | 0.82 | HSD11B1 (0.42) | BACE1HCAR3HCAR2ALDH1A1TSHR | |
| SCHEMBL20795880 | 0.81 | ALOX5 (0.42) | ESR1ESR2ACHELMNAALOX12 | |
| SCHEMBL8767257 | 0.81 | SMN1; SMN2 (0.36) | ALOX12HCAR3HCAR2ALDH1A1TP53 | |
| SCHEMBL8766539 | 0.81 | HTT (0.37) | ACHEHCAR3HCAR2L3MBTL1TP53 | |
| SCHEMBL19382185 | 0.80 | SLC6A4 (0.48) | ACHESLC6A4SLC6A3SLC6A2 | |
| Ethylbenzene SCHEMBL27636949 | 0.78 | HSD11B1 (0.48) | HCAR3HCAR2TP53 | |
| SCHEMBL19357390 | 0.77 | SLC6A4 (0.38) | ACHEHCAR3HCAR2TSHRSLC6A4 | |
| SCHEMBL8766387 | 0.77 | OPRK1 (0.39) | HCAR3HCAR2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0601813-B1 | Diamino compounds and their production method and liquid crystal alignment layers using the compounds | CHISSO CORP (JP) | 1997-08-13 | — | — | EP | disclosed |
| US-5501884-A | Diamino compounds and their production method and liquid crystal alignment layers using the compounds | CHISSO CORPORATION (JP) | 1996-03-26 | — | — | US | disclosed |
| US-5382688-A | Diamino compounds and their production method | CHISSO CORPORATION (JP) | 1995-01-17 | — | — | US | disclosed |
| EP-0601813-A1 | Diamino compounds and their production method and liquid crystal alignment layers using the compounds | CHISSO CORPORATION (JP) | 1994-06-15 | — | — | EP | disclosed |