Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14017898 | 0.84 | TDP1 (0.43) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13657209 | 0.81 | ENPP2 (0.47) | MAPTSMN1; SMN2GAAALDH1A1LMNA | |
| SCHEMBL14028112 | 0.79 | CA2 (0.57) | CYP2C9KDM4EMEN1MAPTKMT2A | |
| SCHEMBL11329269 | 0.79 | HSD17B10 (0.55) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28202109 | 0.79 | GAA (0.40) | CYP1A2CYP2D6CYP2C9CYP2C19MAPT | |
| SCHEMBL28202701 | 0.78 | ESR1 (0.39) | KMT2A | |
| SCHEMBL29159274 | 0.77 | TDP1 (0.49) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL16114955 | 0.74 | ALDH1A1 (0.47) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL634041 | 0.74 | GAA (0.66) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2397432 | 0.74 | ALDH1A1 (0.51) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 |
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-105566182-B | A kind of 2 amino 4（Ethylsulfonyl）The synthetic method of phenol | 苏州天马精细化学品股份有限公司 | 2018-02-13 | — | — | CN | disclosed |