Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.40 |
| ▸ | PPARG | P37231 | 6/20 | 0.40 |
| ▸ | PPARD | Q03181 | 6/20 | 0.40 |
| ▸ | PPARA | Q07869 | 6/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.40 |
| ▸ | TLR2 | O60603 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | FABP4 | P15090 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1882459 | 1.00 | ALOX5 (0.50) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| Hydrochloric Acid SCHEMBL8774075 | 0.98 | ALOX5 (0.49) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| SCHEMBL8774187 | 0.98 | ALOX5 (0.47) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| SCHEMBL8773987 | 0.98 | ALOX5 (0.47) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| SCHEMBL8773985 | 0.98 | ALOX5 (0.47) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| Hydrochloric Acid SCHEMBL8774002 | 0.96 | ALOX5 (0.46) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| Hydrochloric Acid SCHEMBL8774088 | 0.96 | ALOX5 (0.46) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| Hydrochloric Acid SCHEMBL8773999 | 0.96 | ALOX5 (0.46) | ALOX5TP53ALDH1A1S1PR3TSHR | |
| SCHEMBL8774016 | 0.92 | MAPT (0.42) | ALOX5TP53ALDH1A1TSHRHTT | |
| SCHEMBL17610100 | 0.92 | MAPT (0.42) | ALOX5TP53ALDH1A1TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0496896-B1 | CYCLOBUTANECARBOXYLIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME | KANTO KAGAKU (JP) | 1997-11-05 | — | — | EP | disclosed |
| US-5545747-A | STABLE FERROELECTRIC LIQUID CRYSTALLINE COMPOUNDS | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 1996-08-13 | — | — | US | disclosed |
| EP-0496896-A1 | CYCLOBUTANECARBOXYLIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 1992-08-05 | — | — | EP | disclosed |