Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | RGS12 | O14924 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17901036 | 1.00 | KDM4E (0.53) | KDM4EALDH1A1LMNAADRA2CHIF1A | |
| SCHEMBL23250738 | 0.82 | TYR (0.46) | KDM4EALDH1A1LMNAADRA2CHIF1A | |
| SCHEMBL1495894 | 0.80 | LMNA (0.48) | KDM4EALDH1A1LMNAADRA2CADRA2A | |
| SCHEMBL25325632 | 0.80 | LMNA (0.48) | KDM4EALDH1A1LMNAADRA2CADRA2A | |
| SCHEMBL1453272 | 0.79 | CA4 (0.48) | KDM4EALDH1A1LMNAADRA2CADRA2A | |
| SCHEMBL28511974 | 0.78 | KDM4E (0.56) | KDM4EALDH1A1LMNAADRA2CHIF1A | |
| SCHEMBL19725369 | 0.78 | SLC6A4 (0.43) | KDM4ELMNAADRA2CADRA2ACYP2C9 | |
| SCHEMBL11210416 | 0.78 | LMNA (0.47) | KDM4EALDH1A1LMNAADRA2CADRA2A | |
| SCHEMBL17892009 | 0.77 | LMNA (0.45) | KDM4EALDH1A1LMNAADRA2CADRA2A | |
| SCHEMBL1252991 | 0.77 | LMNA (0.45) | KDM4EALDH1A1LMNAADRA2CADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117943084-A | Transition metal catalyst, preparation method and method for preparing organic acid by oxidation and pyrolysis of secondary alcohol | 中国科学院大连化学物理研究所 | 2024-04-30 | — | — | CN | claimed |
| CN-117943084-A | Transition metal catalyst, preparation method and method for preparing organic acid by oxidation and pyrolysis of secondary alcohol | 中国科学院大连化学物理研究所 | 2024-04-30 | — | — | CN | disclosed |