Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PPOX | P50336 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117288 | 1.00 | ALDH1A1 (0.35) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL21756718 | 0.80 | ALDH1A1 (0.36) | ALDH1A1HTTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8734003 | 0.75 | HTT (0.36) | ALDH1A1HTTLMNASMN1; SMN2CYP1A2 | |
| SCHEMBL8214696 | 0.73 | ALDH1A1 (0.37) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL18840210 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL4337299 | 0.69 | ALDH1A1 (0.41) | ALDH1A1HTTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL6050404 | 0.68 | ALDH1A1 (0.37) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL18840197 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL25033807 | 0.68 | ALDH1A1 (0.46) | ALDH1A1HTTPDE4APDE4BPDE4C | |
| SCHEMBL7511104 | 0.68 | ALDH1A1 (0.38) | ALDH1A1HTTPDE4APDE4BPDE4C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3156411-B1 | ARTIFICIAL CATALYST SYSTEM CAPABLE OF SUBSTITUTING FOR IN VIVO ACYLATION FUNCTION | UNIV TOKYO (JP) | 2021-03-03 | — | — | EP | disclosed |
| WO-1995025090-A1 | CYCLIC N-ALKENYLOXYIMIDES AND A METHOD FOR THE PREPARATION OF CYCLIC N-ALKENYLOXYIMIDES, THE CORRESPONDING CYCLIC N-ALKOXYIMIDES AND O-ALKOXYAMINES | DSM N.V. (NL) | 1995-09-21 | — | — | WO | disclosed |