Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 15/20 | 0.63 |
| ▸ | CYP1A1 | P04798 | 14/20 | 0.63 |
| ▸ | CYP1B1 | Q16678 | 14/20 | 0.63 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.51 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.51 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.51 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.51 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.51 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15937803 | 0.85 | NQO1 (0.51) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL15937804 | 0.85 | NQO1 (0.51) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL9239060 | 0.84 | CYP1A1 (0.69) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL9239065 | 0.84 | CYP1A1 (0.69) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL8130457 | 0.81 | CYP1A1 (0.51) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL7103588 | 0.81 | L3MBTL1 (0.46) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL8122560 | 0.80 | CYP1A1 (0.50) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL8124063 | 0.80 | CYP1A1 (0.50) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL8115331 | 0.80 | CYP1A1 (0.50) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 | |
| SCHEMBL8135925 | 0.80 | CYP1A1 (0.50) | CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004000970-A1 | COLOR TUNABLE PHOTOLUMINESCENT BLENDS | CASE WESTERN RESERVE UNIVERSITY (US) | 2003-12-31 | — | — | WO | disclosed |