Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5689099 | 0.89 | C5AR1 (0.42) | ALDH1A1CA12CA9LMNA | |
| SCHEMBL450584 | 0.80 | ESR1 (0.52) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL6842944 | 0.79 | ESR1 (0.46) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL2916785 | 0.78 | ESR1 (0.41) | ESR1PKMCA12CA9 | |
| SCHEMBL378351 | 0.78 | ESR1 (0.50) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL28182966 | 0.78 | ESR1 (0.50) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL11308673 | 0.78 | ESR1 (0.50) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL415688 | 0.78 | ESR1 (0.50) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL11322994 | 0.78 | ESR1 (0.50) | ESR1PKMALDH1A1CA12CA9 | |
| SCHEMBL7069435 | 0.77 | ESR1 (0.48) | ESR1ALDH1A1CA12CA9LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1090962-B1 | Dye mixtures of fiber-reactive azo dyes and use thereof for dyeing material containing hydroxy- and/or carboxamido groups | DYSTAR TEXTILFARBEN GMBH & CO (DE) | 2003-05-14 | — | — | EP | disclosed |
| EP-1090962-A2 | Dye mixtures of fiber-reactive azo dyes and use thereof for dyeing material containing hydroxy- and/or carboxamido groups | DyStar Textilfarben GmbH & Co. Deutschland KG (DE) | 2001-04-11 | — | — | EP | disclosed |