Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21257459 | 0.86 | CYP3A4 (0.37) | CYP3A4TP53TSHRHPGDALOX15 | |
| SCHEMBL9578934 | 0.78 | ALDH1A1 (0.41) | CYP3A4TP53TSHRALDH1A1 | |
| SCHEMBL10569631 | 0.78 | ALDH1A1 (0.45) | CYP3A4TP53TSHRHPGDALOX15 | |
| SCHEMBL8446954 | 0.78 | ALDH1A1 (0.38) | CYP3A4TP53TSHRALDH1A1MAPT | |
| SCHEMBL10573288 | 0.76 | — | — | |
| SCHEMBL30422063 | 0.73 | CYP3A4 (0.52) | CYP3A4TP53TSHRHPGDALOX15 | |
| SCHEMBL3783594 | 0.73 | CYP3A4 (0.52) | CYP3A4TP53TSHRHPGDALOX15 | |
| SCHEMBL23434929 | 0.72 | ALDH1A1 (0.52) | CYP3A4TP53TSHRHPGDALOX15 | |
| SCHEMBL8763541 | 0.72 | ALDH1A1 (0.31) | CYP3A4TSHRALDH1A1 | |
| SCHEMBL8764587 | 0.72 | ALDH1A1 (0.37) | CYP3A4ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0169101-A1 | Process for preparing (hydrocarbylthio)cyclic amines | ETHYL CORPORATION (US) | 1986-01-22 | — | — | EP | claimed |
| US-4866209-A | Poly(hydrocarbylthio)anilines | ETHYL CORPORATION (US) | 1989-09-12 | — | — | US | disclosed |
| EP-0169101-B1 | PROCESS FOR PREPARING (HYDROCARBYLTHIO)CYCLIC AMINES | ETHYL CORPORATION (US) | 1988-08-24 | — | — | EP | disclosed |
| US-4594453-A | Reacting hydrocarbyl disulfide with aromatic amine | ETHYL CORPORATION (US) | 1986-06-10 | — | — | US | disclosed |
| EP-0169101-A1 | Process for preparing (hydrocarbylthio)cyclic amines | ETHYL CORPORATION (US) | 1986-01-22 | — | — | EP | disclosed |