Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 5/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL24125339 | 0.94 | CYP1A2 (0.43) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL20794117 | 0.94 | CYP1A2 (0.44) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL22137141 | 0.93 | CYP1A2 (0.51) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL28513344 | 0.93 | CYP1A2 (0.42) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL21742002 | 0.91 | CYP1A2 (0.43) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL20115131 | 0.91 | CYP1A2 (0.43) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL22243172 | 0.91 | CYP1A2 (0.41) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL22243176 | 0.91 | CYP1A2 (0.41) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL26054836 | 0.91 | CYP1A2 (0.46) | CYP1A2CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL26055013 | 0.91 | CYP1A2 (0.46) | CYP1A2CYP3A4MEN1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112272695-A | Composition of matter for organic light emitting diode | 九州有机光材股份有限公司 | 2021-01-26 | — | — | CN | disclosed |