Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4987796 | 0.90 | KMT2A (0.41) | ESR1ESR2ALDH1A1L3MBTL1 | |
| SCHEMBL11023995 | 0.88 | ALDH1A1 (0.61) | ESR1ESR2ALDH1A1L3MBTL1SLC6A4 | |
| SCHEMBL2841457 | 0.88 | TAAR1 (0.42) | ESR1ESR2ALDH1A1L3MBTL1 | |
| SCHEMBL14625430 | 0.88 | SLC6A3 (0.52) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL12596028 | 0.88 | SLC6A4 (0.53) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL1516123 | 0.88 | ESR2 (0.61) | ESR1ESR2ALDH1A1SLC6A4SLC6A3 | |
| SCHEMBL17274037 | 0.88 | ESR1 (0.35) | ESR1ESR2ALDH1A1L3MBTL1SLC6A4 | |
| SCHEMBL11800829 | 0.87 | KMT2A (0.42) | ESR1ESR2 | |
| SCHEMBL19382448 | 0.87 | SLC6A4 (0.48) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL2387990 | 0.87 | SLC6A4 (0.48) | SLC6A4SLC6A3SLC6A2 |
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-0164417-B1 | THERMAL RECORDING MATERIAL | NIPPON STEEL CHEMICAL CO., LTD. (JP) | 1989-03-15 | — | — | EP | disclosed |
| US-4672401-A | Heat-sensitive recording materials | NIPPON STEEL CHEMICAL CO., LTD. (JP) | 1987-06-09 | — | — | US | disclosed |
| EP-0164417-A1 | THERMAL RECORDING MATERIAL | NIPPON STEEL CHEMICAL CO., LTD. (JP) | 1985-12-18 | — | — | EP | disclosed |
| US-3959226-A | ISOMERIZATION; FRIEDEL-CRAFTS CATALYST | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-05-25 | — | — | US | disclosed |