Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL22501583 | 1.00 | PARP1 (0.47) | PARP1CES2CES1MAOBPARP10 | |
| SCHEMBL31469843 | 0.85 | PLAU (0.42) | PARP1PARP10PLAULOXL2CYP3A4 | |
| SCHEMBL4613289 | 0.85 | PLAU (0.42) | PARP1PARP10PLAULOXL2CYP3A4 | |
| SCHEMBL16951666 | 0.84 | CYP4F2 (0.47) | PARP1CES2CES1MAOBPARP10 | |
| SCHEMBL15888156 | 0.84 | HCAR1 (0.53) | CES2CES1LOXL2HCAR1 | |
| SCHEMBL9970966 | 0.82 | PARP1 (0.46) | PARP1CES2CES1MAOBPARP10 | |
| SCHEMBL7077548 | 0.80 | PARP1 (0.60) | PARP1CES2CES1PTPN11HCAR1 | |
| SCHEMBL259315 | 0.80 | CES2 (0.62) | PARP1CES2CES1PTPN11HCAR1 | |
| SCHEMBL27824440 | 0.79 | CES2 (0.38) | CES2CES1LOXL2HCAR1SMN1; SMN2 | |
| SCHEMBL3874944 | 0.78 | LOXL2 (0.58) | LOXL2PTPN11 |
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-114127050-A | Benzopyran and imidazole derivatives useful for stabilizing amyloidogenic immunoglobulin light chains | 斯克利普斯研究所 | 2022-03-01 | — | — | CN | disclosed |