Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6277396 | 0.73 | KEAP1 (0.40) | LMNAMEN1KMT2AMAPK1ALDH1A1 | |
| SCHEMBL9345237 | 0.73 | ESR1 (0.42) | SLC6A2SLC6A4SLC6A3ESR1ESR2 | |
| SCHEMBL1538376 | 0.71 | RIPK1 (0.42) | SLC6A4SLC6A3ESR1ESR2LMNA | |
| SCHEMBL6281493 | 0.69 | TSHR (0.43) | SLC6A4SLC6A3LMNAMEN1KMT2A | |
| SCHEMBL9279226 | 0.68 | SLC6A2 (0.49) | SLC6A2SLC6A4SLC6A3FFAR4LMNA | |
| SCHEMBL575235 | 0.68 | MAPK1 (0.46) | ESR1ESR2MAPTKMT2ACYP1A2 | |
| SCHEMBL9279074 | 0.68 | MAPK1 (0.46) | ESR1ESR2MAPTKMT2ACYP1A2 | |
| SCHEMBL4352236 | 0.66 | MAPK1 (0.44) | ESR1ESR2MAPTKMT2ACYP1A2 | |
| SCHEMBL2429063 | 0.66 | ALDH1A1 (0.46) | SLC6A4ESR1ESR2LMNAMAPT | |
| Tert-Butylbenzene SCHEMBL11183915 | 0.66 | TSHR (0.55) | ESR1ESR2LMNAMAPK1ALDH1A1 |
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-0652923-A4 | LIQUID SCINTILLATION MEDIUM WITH A 1,2-DICUMYLETHANE SOLVENT. | MIRSKY JEFFREY (US) | 1995-10-11 | — | — | EP | disclosed |
| EP-0652923-A1 | LIQUID SCINTILLATION MEDIUM WITH A 1,2-DICUMYLETHANE SOLVENT | MIRSKY, Jeffrey (US) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994003552-A1 | LIQUID SCINTILLATION MEDIUM WITH A 1,2-DICUMYLETHANE SOLVENT | MIRSKY JEFFREY (US) | 1994-02-17 | — | — | WO | disclosed |