Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047320 | 0.85 | CA1 (0.39) | CA1CA2CA7CA9EGFR | |
| SCHEMBL7043707 | 0.81 | ADORA2A (0.35) | EGFRPDK2ALDH1A1DYRK1A | |
| SCHEMBL7048279 | 0.81 | EGFR (0.33) | EGFRALDH1A1DYRK1A | |
| SCHEMBL10049831 | 0.79 | ALDH1A1 (0.42) | CA1CA2CA7CA9EGFR | |
| SCHEMBL7049632 | 0.79 | EGFR (0.33) | EGFRPDK2ALDH1A1DYRK1A | |
| SCHEMBL7050655 | 0.79 | CA1 (0.35) | CA1CA2CA7CA9EGFR | |
| SCHEMBL255284 | 0.77 | EGFR (0.40) | EGFRALDH1A1 | |
| SCHEMBL29619668 | 0.77 | EGFR (0.40) | EGFRALDH1A1 | |
| SCHEMBL7047198 | 0.76 | MEN1 (0.40) | CA1CA2CA7CA9EGFR | |
| SCHEMBL7049849 | 0.73 | MAPT (0.49) | CA1CA2CA7CA9ALDH1A1 |
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-1300132-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | claimed |
| EP-1300132-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | disclosed |