Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CXCR2 | P25025 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28130804 | 0.87 | ALDH1A1 (0.53) | TSHRCYP3A4ABCB1ABCG2ALDH1A1 | |
| SCHEMBL10404276 | 0.80 | CYP3A4 (0.71) | TSHRCYP3A4ALDH1A1MAPTKDM4E | |
| SCHEMBL25377834 | 0.79 | ALDH1A1 (0.46) | TSHRABCB1ABCG2ALDH1A1MAPT | |
| SCHEMBL3750402 | 0.79 | ALDH1A1 (0.46) | TSHRABCB1ABCG2ALDH1A1MAPT | |
| SCHEMBL12138925 | 0.78 | ALDH1A1 (0.57) | TSHRCYP3A4ABCB1ABCG2ALDH1A1 | |
| SCHEMBL6156438 | 0.77 | ALDH1A1 (0.61) | TSHRCYP3A4ABCG2ALDH1A1MAPT | |
| Phenol SCHEMBL28795047 | 0.77 | CA12 (0.52) | TSHRCYP3A4ABCB1ABCG2ABCC1 | |
| SCHEMBL15145204 | 0.75 | ALDH1A1 (0.53) | TSHRCYP3A4ABCB1ABCG2ABCC1 | |
| SCHEMBL510240 | 0.74 | ALDH1A1 (0.62) | TSHRCYP3A4ABCB1ABCG2ABCC1 | |
| SCHEMBL9481712 | 0.74 | ALDH1A1 (0.62) | TSHRCYP3A4ABCB1ABCG2ABCC1 |
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-0011254-B1 | PROCESS FOR THE PREPARATION OF HYDRO-DIPHENYL AMINES | BAYER AG (DE) | 1982-01-13 | — | — | EP | disclosed |
| US-4265833-A | CATALYTIC AMINATION OF A DIHYDROXYBENZENE WITH A PRIMARY AROMATIC AMINE | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-05 | — | — | US | disclosed |
| EP-0011254-A1 | Process for the preparation of hydro-diphenyl amines | BAYER AG (DE) | 1980-05-28 | — | — | EP | disclosed |