Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | S100B | P04271 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TLR4 | O00206 | 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 | |
|---|---|---|---|---|
| SCHEMBL28092354 | 0.85 | MEN1 (0.40) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL6341576 | 0.83 | KDM4E (0.42) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL28092356 | 0.79 | KDM4E (0.39) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL28092328 | 0.79 | NOS2 (0.42) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL25087166 | 0.75 | TUBB4A (0.39) | ALDH1A1MEN1KMT2AMAPTGAA | |
| SCHEMBL21050869 | 0.75 | TSHR (0.45) | ALDH1A1MEN1KMT2AMAPTGAA | |
| SCHEMBL28092527 | 0.74 | CD44 (0.43) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL29712140 | 0.74 | KDM4E (0.39) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL28092311 | 0.73 | MAPT (0.35) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL28980006 | 0.72 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AMAPTTP53 |
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-105849082-A | Method for producing nitro compound | 住友化学株式会社 | 2016-08-10 | — | — | CN | disclosed |