Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL5132339 | 0.78 | ALDH1A1 (0.46) | GAAALDH1A1LMNASMN1; SMN2ATM | |
| SCHEMBL5132341 | 0.78 | ALDH1A1 (0.46) | GAAALDH1A1LMNASMN1; SMN2ATM | |
| SCHEMBL9304754 | 0.76 | — | — | |
| SCHEMBL14601289 | 0.74 | — | — | |
| SCHEMBL14601291 | 0.73 | ATM (0.35) | GAAALDH1A1LMNASMN1; SMN2ATM | |
| SCHEMBL14565240 | 0.72 | ATM (0.46) | GAAALDH1A1LMNASMN1; SMN2ATM | |
| SCHEMBL15450247 | 0.70 | — | — | |
| SCHEMBL17190715 | 0.70 | — | — | |
| SCHEMBL29493632 | 0.70 | — | — | |
| SCHEMBL12431013 | 0.70 | — | — |
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-102014902-A | Inhibitors of checkpoint kinases | MERCK & CO INC | 2011-04-13 | — | — | CN | disclosed |