Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.31 |
| ▸ | PGK1 | P00558 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL18821935 | 0.87 | NQO2 (0.39) | KDM4ECYP2C19KMT2AALDH1A1TRPA1 | |
| SCHEMBL10593876 | 0.81 | NQO2 (0.50) | TDP1KDM4EKMT2AALDH1A1TRPA1 | |
| SCHEMBL11487445 | 0.79 | SMN1; SMN2 (0.44) | TDP1KDM4ECYP3A4CYP2C19HIF1A | |
| SCHEMBL9091038 | 0.79 | TDP1 (0.44) | TDP1KDM4ECYP3A4CYP2C19HIF1A | |
| SCHEMBL9380128 | 0.79 | CYP4F2 (0.34) | TDP1KDM4ECYP4F2CYP4A11CYP3A4 | |
| SCHEMBL1599285 | 0.77 | ALDH1A1 (0.47) | KDM4ECYP4F2CYP4A11CYP3A4CYP2C19 | |
| SCHEMBL30908291 | 0.76 | KMT2A (0.42) | TDP1KDM4ECYP4F2CYP4A11CYP3A4 | |
| SCHEMBL3275902 | 0.75 | MEN1 (0.39) | KDM4ECYP3A4CYP2C19KMT2AALDH1A1 | |
| SCHEMBL9088568 | 0.75 | TDP1 (0.40) | TDP1KDM4ECYP3A4CYP2C19HIF1A | |
| SCHEMBL1599287 | 0.73 | NOS1 (0.38) | KDM4ECYP4F2CYP4A11CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4184977-A | WHITENING | BAYER AKTIENGESELLSCHAFT (DE) | 1980-01-22 | — | — | US | disclosed |
| EP-0000346-B1 | QUINOXALINE COMPOUNDS, PROCESS FOR THEIR MANUFACTURE AND THEIR USE AS BRIGHTENERS FOR ORGANIC MATERIALS, AND THE MATERIALS BRIGHTENED THEREWITH | BAYER AG (DE) | 1980-01-09 | — | — | EP | disclosed |