Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CTSV | O60911 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL19067196 | 0.80 | CYP1A2 (0.36) | ALDH1A1POLBCYP1A2CYP2C19MAPT | |
| SCHEMBL29144859 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL23061109 | 0.74 | SMN1; SMN2 (0.35) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL29850315 | 0.73 | KDM4E (0.70) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL22680245 | 0.73 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL21906404 | 0.73 | KDM4E (0.70) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL8026149 | 0.73 | KDM4E (0.61) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL28413808 | 0.72 | LTA4H (0.38) | SMN1; SMN2CYP1A2CYP2C19GAACYP2C9 | |
| SCHEMBL28858809 | 0.72 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL28436348 | 0.72 | KDM4E (0.43) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB |
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-108658993-A | A kind of pyrene imide derivative and its synthetic method and application | 兰州大学 | 2018-10-16 | — | — | CN | disclosed |