Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.70 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | LTA4H | P09960 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL49554 | 0.85 | NQO1 (0.70) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL9514574 | 0.85 | NQO1 (0.70) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL9062221 | 0.84 | SMN1; SMN2 (0.51) | NQO1MAPTTDP1POLBKMT2A | |
| 1,4-Diethoxybenzene SCHEMBL124015 | 0.84 | NQO1 (1.00) | NQO1MAPTTDP1POLBALDH1A1 | |
| 1,4-Diethoxybenzene SCHEMBL28186701 | 0.84 | NQO1 (1.00) | NQO1MAPTTDP1POLBALDH1A1 | |
| SCHEMBL947414 | 0.83 | NQO1 (0.67) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL9602387 | 0.83 | NQO1 (0.67) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL20984708 | 0.82 | TDP1 (0.61) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL9785835 | 0.82 | NQO1 (0.52) | NQO1MAPTTDP1POLBKMT2A | |
| SCHEMBL6334250 | 0.81 | NQO1 (0.64) | NQO1MAPTTDP1POLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110734383-A | Green synthesis method of p-phenetidine | 江苏丰华化学工业有限公司 | 2020-01-31 | — | — | CN | claimed |
| US-5874443-A | BIOSYNTHESIS | TREGA BIOSCIENCES, INC. (US) | 1999-02-23 | — | — | US | disclosed |