Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.43 |
| ▸ | NNMT | P40261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | EEF2K | O00418 | 1/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30174294 | 0.79 | CHEK2 (0.40) | NNMTCYP3A4EEF2KSIRT3TDP1 | |
| SCHEMBL28966254 | 0.78 | NEK2 (0.43) | MAPTALDH1A1HPGD | |
| SCHEMBL30174195 | 0.77 | EEF2K (0.41) | CYP2A6CYP3A4EEF2KKMT2AHPGDS | |
| SCHEMBL30174194 | 0.76 | CHEK2 (0.45) | CYP2A6MAPTALDH1A1 | |
| SCHEMBL30174327 | 0.76 | CYP2A6 (0.44) | CYP2A6CYP3A4CYP2B6CYP2C19EEF2K | |
| SCHEMBL30174243 | 0.74 | CHEK1 (0.39) | NNMTEEF2KSIRT3TDP1KMT2A | |
| SCHEMBL30174299 | 0.74 | KDM4E (0.36) | NNMTCYP3A4SIRT3TDP1ALDH1A1 | |
| SCHEMBL29812284 | 0.72 | LMNA (0.44) | TDP1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL30174264 | 0.72 | NNMT (0.39) | NNMTKMT2AHPGDS | |
| Hydrochloric Acid SCHEMBL29812079 | 0.71 | LMNA (0.44) | TDP1MAPTMEN1KMT2ANPC1 |
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-115605478-A | Compounds and methods of use | 埃克塞里艾克西斯公司（US） | 2023-01-13 | — | — | CN | disclosed |