Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.40 |
| ▸ | ERN1 | O75460 | 2/20 | 0.39 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.37 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.37 |
| ▸ | EEF2K | O00418 | 1/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | TTR | P02766 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1984171 | 0.83 | HMGB1 (0.55) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL143965 | 0.80 | CYP2C9 (0.56) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL3308517 | 0.79 | ALDH1A1 (0.44) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL4756917 | 0.78 | ERN1 (0.50) | ERN1FNTAFNTBTTRMAPT | |
| SCHEMBL4757716 | 0.77 | KMT2A (0.49) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL23685779 | 0.76 | KDM4E (0.50) | ERN1HMGB1CXCL12MAPTSIRT3 | |
| SCHEMBL3612970 | 0.76 | POLB (0.46) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL4757723 | 0.76 | CYP3A4 (0.50) | CYP3A4ERN1MAPTTDP1 | |
| SCHEMBL1800318 | 0.76 | PARP10 (0.44) | SRCERN1PTGS2SIRT3TDP1 | |
| SCHEMBL15650835 | 0.76 | TDP1 (0.43) | PTGS2SIRT3TDP1NNMT |
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 |