Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4788121 | 0.84 | PTP4A1 (0.47) | CYP3A4USP2CA12CA1CA2 | |
| SCHEMBL3308517 | 0.83 | ALDH1A1 (0.44) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL4755043 | 0.83 | ERN1 (0.54) | CYP3A4USP2ERN1TDP1MAPT | |
| SCHEMBL5460234 | 0.82 | ALDH1A1 (0.52) | CYP3A4TSHRSMN1; SMN2TDP1MAPT | |
| SCHEMBL10627374 | 0.80 | CA12 (0.59) | CYP3A4USP2CA12CA1CA2 | |
| SCHEMBL8698869 | 0.79 | CA12 (0.50) | CYP3A4USP2CA12CA1CA2 | |
| SCHEMBL1984171 | 0.78 | HMGB1 (0.55) | CYP3A4TDP1MAPTGAAALDH1A1 | |
| SCHEMBL4755004 | 0.77 | CA12 (0.66) | CYP3A4USP2CA12CA1CA2 | |
| SCHEMBL23796484 | 0.77 | CA12 (0.65) | CYP3A4CA12CA1CA2CA7 | |
| SCHEMBL4867955 | 0.77 | CA12 (0.47) | CYP3A4USP2CA12CA1CA2 |
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-1879661-A1 | AGENT FOR DYEING KERATIN-BASED FIBRES | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2008-01-23 | — | — | EP | claimed |
| WO-2006119821-A1 | AGENT FOR DYEING KERATIN-BASED FIBRES | HENKEL KOMMANDITGESELLCHAFT AUF AKTIEN (DE) | 2006-11-16 | — | — | WO | claimed |