Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Thiobenzoic Acid SCHEMBL29035901 | 0.85 | SMN1; SMN2 (0.37) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| Thiobenzoic Acid SCHEMBL28537193 | 0.85 | CES2 (0.44) | CES2CES1HTTALDH1A1MAPT | |
| Chlorobenzene SCHEMBL27535476 | 0.81 | TSHR (0.44) | ALDH1A1MAPTLMNACTSC | |
| Thiobenzoic Acid SCHEMBL21838348 | 0.78 | CES2 (0.47) | CES2CES1HTTALDH1A1MAPT | |
| Thiobenzoic Acid SCHEMBL21633501 | 0.78 | CES2 (0.47) | CES2CES1ALDH1A1MAPTMEN1 | |
| Thiobenzoic Acid SCHEMBL28579899 | 0.78 | CES2 (0.54) | CES2CES1ALDH1A1MAPTMEN1 | |
| Thiobenzoic Acid SCHEMBL29155255 | 0.77 | SLC6A2 (0.38) | CES2CES1ALDH1A1MAPTLMNA | |
| Thiobenzoic Acid SCHEMBL21980745 | 0.77 | CES2 (0.46) | CES2CES1ALDH1A1MAPTMEN1 | |
| Thiobenzoic Acid SCHEMBL26659968 | 0.76 | CES2 (0.42) | CES2CES1HTTALDH1A1MAPT | |
| Isopropylbenzene SCHEMBL21641784 | 0.75 | CES2 (0.47) | CES2CES1HTTALDH1A1MAPT |
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-112533990-B | Rubber composition, vulcanized rubber, and molded article of the vulcanized rubber | 电化株式会社 | 2023-07-21 | — | — | CN | disclosed |