Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28594834 | 0.86 | HSD11B1 (0.51) | ALDH1A1CYP3A4CYP2C19CYP1A2POLB | |
| SCHEMBL17710447 | 0.78 | BCHE (0.63) | ALDH1A1MAPTGAAKDM4EBCHE | |
| SCHEMBL3187928 | 0.76 | ALDH1A1 (0.46) | ALDH1A1MAPTCYP3A4CYP2C19CYP1A2 | |
| SCHEMBL15618825 | 0.76 | ALDH1A1 (0.60) | ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL27610549 | 0.74 | ALDH1A1 (0.44) | ALDH1A1MAPTCYP3A4CYP2C19CYP1A2 | |
| SCHEMBL29462463 | 0.71 | ALDH1A1 (0.46) | PAX8ALDH1A1MAPTCYP1A2GAA | |
| SCHEMBL2338643 | 0.70 | PTPN1 (0.43) | ALDH1A1MAPTCYP3A4POLB | |
| SCHEMBL15929606 | 0.70 | HTT (0.58) | ALDH1A1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6938990 | 0.69 | GFER (0.61) | ALDH1A1MAPTPOLBGAAKDM4E | |
| SCHEMBL6938287 | 0.69 | GFER (0.54) | ALDH1A1MAPTGAAKDM4EHPGD |
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-111269154-B | Synthetic method of aryl and/or alkyl methane compound containing sulfonyl | 台州学院 | 2021-10-08 | — | — | CN | disclosed |
| CN-111269154-A | Synthetic method of aryl and/or alkyl methane compound containing sulfonyl | 台州学院 | 2020-06-12 | — | — | CN | disclosed |